NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
463517 |
2yqi   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2yqi
save_distance_constraint_statistics_1
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 1
_Distance_constraint_stats_list.Constraint_count 1617
_Distance_constraint_stats_list.Viol_count 305
_Distance_constraint_stats_list.Viol_total 86.651
_Distance_constraint_stats_list.Viol_max 0.112
_Distance_constraint_stats_list.Viol_rms 0.0026
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0001
_Distance_constraint_stats_list.Viol_average_violations_only 0.0142
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 9 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 10 PRO 0.013 0.004 5 0 "[ . 1 . 2]"
1 11 LYS 0.004 0.004 5 0 "[ . 1 . 2]"
1 12 ARG 0.001 0.000 15 0 "[ . 1 . 2]"
1 13 PRO 0.000 0.000 15 0 "[ . 1 . 2]"
1 14 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 15 SER 0.000 0.000 5 0 "[ . 1 . 2]"
1 16 GLY 0.000 0.000 10 0 "[ . 1 . 2]"
1 17 PHE 0.006 0.006 17 0 "[ . 1 . 2]"
1 18 PHE 0.010 0.005 8 0 "[ . 1 . 2]"
1 19 LEU 0.016 0.006 17 0 "[ . 1 . 2]"
1 20 PHE 0.018 0.006 17 0 "[ . 1 . 2]"
1 21 CYS 0.023 0.005 8 0 "[ . 1 . 2]"
1 22 SER 0.009 0.006 17 0 "[ . 1 . 2]"
1 23 GLU 0.164 0.056 18 0 "[ . 1 . 2]"
1 24 PHE 0.082 0.041 18 0 "[ . 1 . 2]"
1 25 ARG 0.009 0.005 18 0 "[ . 1 . 2]"
1 26 PRO 0.003 0.002 16 0 "[ . 1 . 2]"
1 27 LYS 0.004 0.002 9 0 "[ . 1 . 2]"
1 28 ILE 0.086 0.017 16 0 "[ . 1 . 2]"
1 29 LYS 0.035 0.024 16 0 "[ . 1 . 2]"
1 30 SER 1.462 0.083 5 0 "[ . 1 . 2]"
1 31 THR 1.753 0.098 15 0 "[ . 1 . 2]"
1 32 ASN 1.251 0.098 15 0 "[ . 1 . 2]"
1 33 PRO 0.989 0.045 2 0 "[ . 1 . 2]"
1 35 ILE 0.074 0.010 19 0 "[ . 1 . 2]"
1 36 SER 0.008 0.006 19 0 "[ . 1 . 2]"
1 37 ILE 0.001 0.000 7 0 "[ . 1 . 2]"
1 38 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 39 ASP 0.040 0.010 19 0 "[ . 1 . 2]"
1 40 VAL 0.039 0.006 5 0 "[ . 1 . 2]"
1 41 ALA 0.005 0.003 20 0 "[ . 1 . 2]"
1 42 LYS 0.016 0.004 18 0 "[ . 1 . 2]"
1 43 LYS 0.039 0.010 17 0 "[ . 1 . 2]"
1 44 LEU 0.048 0.021 17 0 "[ . 1 . 2]"
1 45 GLY 0.061 0.025 12 0 "[ . 1 . 2]"
1 46 GLU 0.152 0.049 16 0 "[ . 1 . 2]"
1 47 MET 0.237 0.074 17 0 "[ . 1 . 2]"
1 48 TRP 0.238 0.074 17 0 "[ . 1 . 2]"
1 49 ASN 0.000 0.000 4 0 "[ . 1 . 2]"
1 50 ASN 0.006 0.003 12 0 "[ . 1 . 2]"
1 51 LEU 0.006 0.004 17 0 "[ . 1 . 2]"
1 52 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 53 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 54 SER 0.004 0.004 17 0 "[ . 1 . 2]"
1 55 GLU 0.020 0.005 9 0 "[ . 1 . 2]"
1 56 LYS 0.308 0.021 8 0 "[ . 1 . 2]"
1 57 GLN 0.018 0.004 17 0 "[ . 1 . 2]"
1 58 PRO 0.368 0.021 8 0 "[ . 1 . 2]"
1 59 TYR 0.079 0.009 16 0 "[ . 1 . 2]"
1 60 ILE 0.030 0.008 18 0 "[ . 1 . 2]"
1 61 THR 0.002 0.002 18 0 "[ . 1 . 2]"
1 62 LYS 0.006 0.006 19 0 "[ . 1 . 2]"
1 63 ALA 0.003 0.002 10 0 "[ . 1 . 2]"
1 64 ALA 0.001 0.001 1 0 "[ . 1 . 2]"
1 65 LYS 0.148 0.112 19 0 "[ . 1 . 2]"
1 66 LEU 0.075 0.018 13 0 "[ . 1 . 2]"
1 67 LYS 0.003 0.001 16 0 "[ . 1 . 2]"
1 68 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 69 LYS 0.071 0.038 20 0 "[ . 1 . 2]"
1 70 TYR 0.006 0.001 16 0 "[ . 1 . 2]"
1 71 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 72 LYS 0.002 0.001 19 0 "[ . 1 . 2]"
1 73 ASP 0.003 0.002 19 0 "[ . 1 . 2]"
1 74 VAL 0.004 0.002 8 0 "[ . 1 . 2]"
1 75 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 76 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 77 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 78 LYS 0.003 0.003 6 0 "[ . 1 . 2]"
1 79 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 80 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 9 ALA HA 1 10 PRO HD2 . . 3.150 2.343 2.202 2.627 . 0 0 "[ . 1 . 2]" 1
2 1 9 ALA HA 1 10 PRO QD . . 2.690 2.061 1.984 2.232 . 0 0 "[ . 1 . 2]" 1
3 1 9 ALA HA 1 10 PRO HD3 . . 3.150 2.289 2.254 2.414 . 0 0 "[ . 1 . 2]" 1
4 1 9 ALA HA 1 10 PRO HG2 . . 5.280 4.467 4.354 4.701 . 0 0 "[ . 1 . 2]" 1
5 1 9 ALA HA 1 10 PRO QG . . 4.530 3.969 3.885 4.153 . 0 0 "[ . 1 . 2]" 1
6 1 9 ALA HA 1 10 PRO HG3 . . 5.280 4.444 4.369 4.625 . 0 0 "[ . 1 . 2]" 1
7 1 9 ALA HA 1 77 TYR QD . . 4.570 3.501 2.741 4.118 . 0 0 "[ . 1 . 2]" 1
8 1 9 ALA HA 1 77 TYR QE . . 4.560 3.435 2.344 4.330 . 0 0 "[ . 1 . 2]" 1
9 1 9 ALA MB 1 10 PRO HD2 . . 3.890 2.245 1.925 2.547 . 0 0 "[ . 1 . 2]" 1
10 1 9 ALA MB 1 10 PRO QD . . 3.130 2.212 1.903 2.494 . 0 0 "[ . 1 . 2]" 1
11 1 9 ALA MB 1 10 PRO HD3 . . 3.890 3.347 2.988 3.564 . 0 0 "[ . 1 . 2]" 1
12 1 9 ALA MB 1 10 PRO QG . . 4.960 3.655 3.336 3.834 . 0 0 "[ . 1 . 2]" 1
13 1 9 ALA MB 1 77 TYR QD . . 4.370 3.672 2.416 4.363 . 0 0 "[ . 1 . 2]" 1
14 1 9 ALA MB 1 77 TYR QE . . 3.930 2.955 2.314 3.785 . 0 0 "[ . 1 . 2]" 1
15 1 10 PRO HA 1 11 LYS H . . 3.010 2.305 2.153 2.524 . 0 0 "[ . 1 . 2]" 1
16 1 10 PRO HA 1 11 LYS QB . . 4.640 4.395 4.195 4.603 . 0 0 "[ . 1 . 2]" 1
17 1 10 PRO HA 1 11 LYS HG2 . . 5.140 4.322 3.264 5.124 . 0 0 "[ . 1 . 2]" 1
18 1 10 PRO HA 1 11 LYS HG3 . . 5.140 4.460 3.265 5.144 0.004 5 0 "[ . 1 . 2]" 1
19 1 10 PRO QB 1 70 TYR QD . . 3.630 2.736 2.270 3.012 . 0 0 "[ . 1 . 2]" 1
20 1 10 PRO QB 1 70 TYR QE . . 3.690 2.345 1.990 3.186 . 0 0 "[ . 1 . 2]" 1
21 1 10 PRO QB 1 73 ASP HB2 . . 4.220 3.593 2.864 4.221 0.001 18 0 "[ . 1 . 2]" 1
22 1 10 PRO QB 1 73 ASP HB3 . . 3.960 2.912 2.162 3.812 . 0 0 "[ . 1 . 2]" 1
23 1 10 PRO QB 1 74 VAL QG . . 4.740 3.205 2.697 3.649 . 0 0 "[ . 1 . 2]" 1
24 1 10 PRO HB2 1 11 LYS H . . 4.490 2.939 2.316 3.542 . 0 0 "[ . 1 . 2]" 1
25 1 10 PRO HB2 1 70 TYR QD . . 4.240 2.783 2.294 3.082 . 0 0 "[ . 1 . 2]" 1
26 1 10 PRO HB2 1 73 ASP HB2 . . 4.920 4.308 3.417 4.920 . 0 0 "[ . 1 . 2]" 1
27 1 10 PRO HB3 1 11 LYS H . . 4.490 3.645 3.311 4.006 . 0 0 "[ . 1 . 2]" 1
28 1 10 PRO HB3 1 70 TYR QD . . 4.240 4.065 3.611 4.241 0.001 2 0 "[ . 1 . 2]" 1
29 1 10 PRO HB3 1 73 ASP HB2 . . 4.920 3.871 3.050 4.741 . 0 0 "[ . 1 . 2]" 1
30 1 10 PRO QD 1 74 VAL HA . . 4.460 3.910 2.838 4.414 . 0 0 "[ . 1 . 2]" 1
31 1 10 PRO QD 1 74 VAL QG . . 4.220 3.715 2.938 4.222 0.002 8 0 "[ . 1 . 2]" 1
32 1 10 PRO QD 1 77 TYR QB . . 3.690 3.182 2.447 3.658 . 0 0 "[ . 1 . 2]" 1
33 1 10 PRO HD2 1 77 TYR QB . . 4.200 3.710 2.882 4.198 . 0 0 "[ . 1 . 2]" 1
34 1 10 PRO HD2 1 77 TYR QD . . 4.460 3.622 3.028 4.251 . 0 0 "[ . 1 . 2]" 1
35 1 10 PRO HD3 1 77 TYR QB . . 4.200 3.483 2.646 4.033 . 0 0 "[ . 1 . 2]" 1
36 1 10 PRO HD3 1 77 TYR QD . . 4.460 3.460 2.481 4.364 . 0 0 "[ . 1 . 2]" 1
37 1 10 PRO QG 1 70 TYR QD . . 4.410 3.989 3.205 4.411 0.001 14 0 "[ . 1 . 2]" 1
38 1 10 PRO QG 1 70 TYR QE . . 4.080 2.982 2.043 3.377 . 0 0 "[ . 1 . 2]" 1
39 1 10 PRO QG 1 73 ASP HB2 . . 4.520 3.688 2.998 4.408 . 0 0 "[ . 1 . 2]" 1
40 1 10 PRO QG 1 73 ASP HB3 . . 3.720 2.562 2.012 2.921 . 0 0 "[ . 1 . 2]" 1
41 1 10 PRO QG 1 74 VAL HA . . 3.650 2.822 2.500 3.237 . 0 0 "[ . 1 . 2]" 1
42 1 10 PRO QG 1 74 VAL QG . . 3.830 2.326 1.871 2.854 . 0 0 "[ . 1 . 2]" 1
43 1 10 PRO QG 1 77 TYR QB . . 4.160 3.387 2.645 3.929 . 0 0 "[ . 1 . 2]" 1
44 1 10 PRO QG 1 77 TYR QD . . 5.350 4.186 2.977 5.023 . 0 0 "[ . 1 . 2]" 1
45 1 10 PRO HG2 1 70 TYR QE . . 4.640 3.055 2.058 3.470 . 0 0 "[ . 1 . 2]" 1
46 1 10 PRO HG2 1 73 ASP HB3 . . 4.290 4.084 3.512 4.292 0.002 19 0 "[ . 1 . 2]" 1
47 1 10 PRO HG2 1 74 VAL HA . . 4.160 3.378 2.913 3.811 . 0 0 "[ . 1 . 2]" 1
48 1 10 PRO HG2 1 77 TYR QB . . 4.820 4.333 3.444 4.724 . 0 0 "[ . 1 . 2]" 1
49 1 10 PRO HG3 1 70 TYR QE . . 4.640 4.222 3.466 4.631 . 0 0 "[ . 1 . 2]" 1
50 1 10 PRO HG3 1 73 ASP HB3 . . 4.290 2.591 2.023 2.978 . 0 0 "[ . 1 . 2]" 1
51 1 10 PRO HG3 1 74 VAL HA . . 4.160 3.046 2.595 3.697 . 0 0 "[ . 1 . 2]" 1
52 1 10 PRO HG3 1 77 TYR QB . . 4.820 3.541 2.749 4.208 . 0 0 "[ . 1 . 2]" 1
53 1 11 LYS H 1 11 LYS HB2 . . 4.080 3.078 2.332 3.855 . 0 0 "[ . 1 . 2]" 1
54 1 11 LYS H 1 11 LYS QB . . 3.380 2.698 2.304 3.203 . 0 0 "[ . 1 . 2]" 1
55 1 11 LYS H 1 11 LYS HB3 . . 4.080 3.419 2.523 3.945 . 0 0 "[ . 1 . 2]" 1
56 1 11 LYS H 1 11 LYS HG2 . . 4.910 3.002 1.935 4.321 . 0 0 "[ . 1 . 2]" 1
57 1 11 LYS H 1 11 LYS QG . . 4.100 2.460 1.914 3.110 . 0 0 "[ . 1 . 2]" 1
58 1 11 LYS H 1 11 LYS HG3 . . 4.910 2.960 2.007 4.094 . 0 0 "[ . 1 . 2]" 1
59 1 11 LYS HA 1 11 LYS QD . . 4.750 3.778 2.290 4.398 . 0 0 "[ . 1 . 2]" 1
60 1 11 LYS HA 1 11 LYS QG . . 3.630 2.884 2.269 3.424 . 0 0 "[ . 1 . 2]" 1
61 1 11 LYS HA 1 12 ARG H . . 3.160 2.271 2.143 2.449 . 0 0 "[ . 1 . 2]" 1
62 1 11 LYS HA 1 12 ARG HA . . 4.680 4.315 4.294 4.367 . 0 0 "[ . 1 . 2]" 1
63 1 11 LYS HA 1 70 TYR QE . . 4.810 3.500 2.863 4.015 . 0 0 "[ . 1 . 2]" 1
64 1 11 LYS QB 1 11 LYS QG . . 2.260 2.060 2.018 2.087 . 0 0 "[ . 1 . 2]" 1
65 1 11 LYS QB 1 12 ARG H . . 4.160 2.781 2.322 3.300 . 0 0 "[ . 1 . 2]" 1
66 1 11 LYS HB2 1 12 ARG H . . 4.910 3.409 2.529 4.322 . 0 0 "[ . 1 . 2]" 1
67 1 11 LYS HB3 1 12 ARG H . . 4.910 3.341 2.361 4.180 . 0 0 "[ . 1 . 2]" 1
68 1 12 ARG H 1 12 ARG QB . . 3.410 2.341 2.133 2.628 . 0 0 "[ . 1 . 2]" 1
69 1 12 ARG H 1 12 ARG QD . . 5.310 3.764 2.082 4.687 . 0 0 "[ . 1 . 2]" 1
70 1 12 ARG H 1 12 ARG HG2 . . 4.830 3.706 2.276 4.579 . 0 0 "[ . 1 . 2]" 1
71 1 12 ARG H 1 12 ARG QG . . 4.220 2.751 2.007 3.923 . 0 0 "[ . 1 . 2]" 1
72 1 12 ARG H 1 12 ARG HG3 . . 4.830 2.913 2.042 4.408 . 0 0 "[ . 1 . 2]" 1
73 1 12 ARG H 1 70 TYR QE . . 5.130 3.826 2.928 4.499 . 0 0 "[ . 1 . 2]" 1
74 1 12 ARG HA 1 12 ARG QD . . 4.690 3.809 2.716 4.254 . 0 0 "[ . 1 . 2]" 1
75 1 12 ARG HA 1 12 ARG HG2 . . 4.200 2.776 2.177 3.787 . 0 0 "[ . 1 . 2]" 1
76 1 12 ARG HA 1 12 ARG QG . . 3.650 2.377 2.139 3.311 . 0 0 "[ . 1 . 2]" 1
77 1 12 ARG HA 1 12 ARG HG3 . . 4.200 2.838 2.276 3.654 . 0 0 "[ . 1 . 2]" 1
78 1 12 ARG HA 1 13 PRO HD2 . . 3.100 2.229 2.141 2.292 . 0 0 "[ . 1 . 2]" 1
79 1 12 ARG HA 1 13 PRO HD3 . . 3.100 2.257 2.253 2.266 . 0 0 "[ . 1 . 2]" 1
80 1 12 ARG HA 1 13 PRO HG2 . . 4.900 4.375 4.305 4.425 . 0 0 "[ . 1 . 2]" 1
81 1 12 ARG HA 1 13 PRO QG . . 4.180 3.900 3.853 3.936 . 0 0 "[ . 1 . 2]" 1
82 1 12 ARG HA 1 13 PRO HG3 . . 4.900 4.382 4.345 4.411 . 0 0 "[ . 1 . 2]" 1
83 1 12 ARG HA 1 70 TYR QD . . 4.340 3.665 3.132 3.929 . 0 0 "[ . 1 . 2]" 1
84 1 12 ARG HA 1 70 TYR QE . . 3.940 3.108 2.812 3.313 . 0 0 "[ . 1 . 2]" 1
85 1 12 ARG QB 1 12 ARG QD . . 3.370 2.201 2.016 2.695 . 0 0 "[ . 1 . 2]" 1
86 1 12 ARG QB 1 13 PRO QD . . 3.930 2.559 2.272 3.289 . 0 0 "[ . 1 . 2]" 1
87 1 12 ARG QD 1 70 TYR QE . . 5.370 4.645 3.110 5.314 . 0 0 "[ . 1 . 2]" 1
88 1 12 ARG QG 1 13 PRO QD . . 4.030 2.798 1.810 4.030 0.000 15 0 "[ . 1 . 2]" 1
89 1 12 ARG QG 1 70 TYR QE . . 4.360 3.278 2.890 4.360 0.000 15 0 "[ . 1 . 2]" 1
90 1 12 ARG HG2 1 70 TYR QE . . 5.100 3.807 3.029 4.964 . 0 0 "[ . 1 . 2]" 1
91 1 12 ARG HG3 1 70 TYR QE . . 5.100 3.933 2.929 5.078 . 0 0 "[ . 1 . 2]" 1
92 1 13 PRO HA 1 14 PRO HD2 . . 3.000 2.229 2.122 2.247 . 0 0 "[ . 1 . 2]" 1
93 1 13 PRO HA 1 14 PRO HD3 . . 2.830 2.265 2.262 2.267 . 0 0 "[ . 1 . 2]" 1
94 1 13 PRO HA 1 14 PRO HG2 . . 5.240 4.379 4.294 4.394 . 0 0 "[ . 1 . 2]" 1
95 1 13 PRO HA 1 14 PRO QG . . 4.360 3.905 3.848 3.915 . 0 0 "[ . 1 . 2]" 1
96 1 13 PRO HA 1 14 PRO HG3 . . 5.240 4.388 4.346 4.395 . 0 0 "[ . 1 . 2]" 1
97 1 13 PRO HA 1 66 LEU HB3 . . 4.700 3.678 3.020 4.056 . 0 0 "[ . 1 . 2]" 1
98 1 13 PRO HA 1 66 LEU QD . . 5.280 3.833 3.341 4.573 . 0 0 "[ . 1 . 2]" 1
99 1 13 PRO HA 1 70 TYR QB . . 5.340 4.377 4.103 4.694 . 0 0 "[ . 1 . 2]" 1
100 1 13 PRO QB 1 14 PRO HD2 . . 3.360 2.593 2.556 2.806 . 0 0 "[ . 1 . 2]" 1
101 1 13 PRO QB 1 14 PRO HD3 . . 4.350 3.673 3.646 3.833 . 0 0 "[ . 1 . 2]" 1
102 1 13 PRO QB 1 66 LEU HB3 . . 4.320 2.324 1.872 2.678 . 0 0 "[ . 1 . 2]" 1
103 1 13 PRO QB 1 66 LEU QD . . 4.740 3.245 2.763 3.756 . 0 0 "[ . 1 . 2]" 1
104 1 13 PRO QB 1 67 LYS HA . . 4.520 2.980 2.488 3.475 . 0 0 "[ . 1 . 2]" 1
105 1 13 PRO QB 1 70 TYR HB2 . . 5.250 3.008 2.666 3.361 . 0 0 "[ . 1 . 2]" 1
106 1 13 PRO QB 1 70 TYR QB . . 4.520 2.893 2.574 3.148 . 0 0 "[ . 1 . 2]" 1
107 1 13 PRO QB 1 70 TYR HB3 . . 5.250 3.808 3.337 4.232 . 0 0 "[ . 1 . 2]" 1
108 1 13 PRO QB 1 70 TYR QD . . 5.350 4.275 3.891 4.637 . 0 0 "[ . 1 . 2]" 1
109 1 13 PRO QD 1 70 TYR QD . . 3.630 2.751 2.423 2.901 . 0 0 "[ . 1 . 2]" 1
110 1 13 PRO HD2 1 70 TYR QD . . 4.270 3.686 3.495 4.025 . 0 0 "[ . 1 . 2]" 1
111 1 13 PRO HD2 1 70 TYR QE . . 4.830 3.871 3.462 4.247 . 0 0 "[ . 1 . 2]" 1
112 1 13 PRO HD3 1 70 TYR QD . . 4.270 2.841 2.466 2.997 . 0 0 "[ . 1 . 2]" 1
113 1 13 PRO HD3 1 70 TYR QE . . 4.830 3.584 3.129 3.997 . 0 0 "[ . 1 . 2]" 1
114 1 13 PRO QG 1 67 LYS HA . . 3.630 2.055 1.977 2.349 . 0 0 "[ . 1 . 2]" 1
115 1 13 PRO QG 1 67 LYS QG . . 4.150 3.126 2.478 3.717 . 0 0 "[ . 1 . 2]" 1
116 1 13 PRO QG 1 70 TYR H . . 5.220 4.474 4.031 4.916 . 0 0 "[ . 1 . 2]" 1
117 1 13 PRO QG 1 70 TYR QB . . 3.780 2.665 2.270 3.093 . 0 0 "[ . 1 . 2]" 1
118 1 13 PRO QG 1 70 TYR QD . . 4.370 3.359 2.871 3.726 . 0 0 "[ . 1 . 2]" 1
119 1 14 PRO HA 1 15 SER H . . 2.990 2.332 2.156 2.639 . 0 0 "[ . 1 . 2]" 1
120 1 14 PRO HA 1 18 PHE HB2 . . 4.550 4.124 3.717 4.502 . 0 0 "[ . 1 . 2]" 1
121 1 14 PRO HA 1 18 PHE HB3 . . 4.350 3.474 2.948 3.825 . 0 0 "[ . 1 . 2]" 1
122 1 14 PRO HA 1 18 PHE QD . . 5.000 4.123 3.734 4.490 . 0 0 "[ . 1 . 2]" 1
123 1 14 PRO QB 1 18 PHE HB2 . . 4.050 3.788 3.454 4.047 . 0 0 "[ . 1 . 2]" 1
124 1 14 PRO QB 1 18 PHE HB3 . . 3.680 2.475 2.124 2.727 . 0 0 "[ . 1 . 2]" 1
125 1 14 PRO QB 1 18 PHE QE . . 4.710 3.338 2.968 3.971 . 0 0 "[ . 1 . 2]" 1
126 1 14 PRO QB 1 19 LEU QD . . 3.740 2.314 1.822 2.801 . 0 0 "[ . 1 . 2]" 1
127 1 14 PRO HB2 1 15 SER H . . 4.080 2.838 2.070 3.508 . 0 0 "[ . 1 . 2]" 1
128 1 14 PRO HB2 1 18 PHE HB2 . . 4.660 4.127 3.773 4.451 . 0 0 "[ . 1 . 2]" 1
129 1 14 PRO HB2 1 18 PHE HB3 . . 4.240 2.557 2.168 2.863 . 0 0 "[ . 1 . 2]" 1
130 1 14 PRO HB2 1 18 PHE QD . . 4.360 2.546 2.052 3.471 . 0 0 "[ . 1 . 2]" 1
131 1 14 PRO HB3 1 15 SER H . . 4.080 3.584 3.208 3.983 . 0 0 "[ . 1 . 2]" 1
132 1 14 PRO HB3 1 18 PHE HB2 . . 4.660 4.417 4.005 4.649 . 0 0 "[ . 1 . 2]" 1
133 1 14 PRO HB3 1 18 PHE HB3 . . 4.240 3.328 3.047 3.658 . 0 0 "[ . 1 . 2]" 1
134 1 14 PRO HB3 1 18 PHE QD . . 4.360 2.760 2.199 3.441 . 0 0 "[ . 1 . 2]" 1
135 1 14 PRO HD2 1 19 LEU MD1 . . 5.500 4.495 3.849 5.130 . 0 0 "[ . 1 . 2]" 1
136 1 14 PRO HD2 1 19 LEU QD . . 4.490 3.859 3.644 4.004 . 0 0 "[ . 1 . 2]" 1
137 1 14 PRO HD2 1 19 LEU MD2 . . 5.500 4.519 3.862 5.463 . 0 0 "[ . 1 . 2]" 1
138 1 14 PRO HD2 1 66 LEU HB2 . . 5.140 3.512 2.898 3.950 . 0 0 "[ . 1 . 2]" 1
139 1 14 PRO HD2 1 66 LEU HB3 . . 4.010 2.801 2.428 3.233 . 0 0 "[ . 1 . 2]" 1
140 1 14 PRO HD2 1 66 LEU QD . . 3.850 2.579 1.934 3.540 . 0 0 "[ . 1 . 2]" 1
141 1 14 PRO HD3 1 19 LEU QD . . 4.800 4.289 3.946 4.469 . 0 0 "[ . 1 . 2]" 1
142 1 14 PRO HD3 1 66 LEU HB3 . . 4.900 4.377 3.861 4.809 . 0 0 "[ . 1 . 2]" 1
143 1 14 PRO HD3 1 66 LEU QD . . 4.800 3.501 3.009 4.479 . 0 0 "[ . 1 . 2]" 1
144 1 14 PRO QG 1 18 PHE HB3 . . 5.040 4.396 4.055 4.666 . 0 0 "[ . 1 . 2]" 1
145 1 14 PRO QG 1 18 PHE QD . . 4.620 3.645 3.032 4.589 . 0 0 "[ . 1 . 2]" 1
146 1 14 PRO QG 1 18 PHE QE . . 5.350 4.093 3.145 5.188 . 0 0 "[ . 1 . 2]" 1
147 1 14 PRO QG 1 19 LEU QD . . 3.130 1.995 1.841 2.150 . 0 0 "[ . 1 . 2]" 1
148 1 14 PRO QG 1 66 LEU HB3 . . 5.080 4.058 3.573 4.508 . 0 0 "[ . 1 . 2]" 1
149 1 14 PRO QG 1 66 LEU QD . . 3.720 2.614 1.785 3.650 . 0 0 "[ . 1 . 2]" 1
150 1 14 PRO HG2 1 18 PHE QD . . 5.500 4.378 3.649 5.445 . 0 0 "[ . 1 . 2]" 1
151 1 14 PRO HG3 1 18 PHE QD . . 5.500 3.903 3.200 4.941 . 0 0 "[ . 1 . 2]" 1
152 1 15 SER H 1 15 SER QB . . 3.630 2.518 2.304 2.892 . 0 0 "[ . 1 . 2]" 1
153 1 15 SER H 1 18 PHE H . . 4.660 3.297 3.051 3.864 . 0 0 "[ . 1 . 2]" 1
154 1 15 SER H 1 18 PHE HB2 . . 3.860 2.888 2.494 3.364 . 0 0 "[ . 1 . 2]" 1
155 1 15 SER H 1 18 PHE HB3 . . 3.720 2.226 1.913 2.846 . 0 0 "[ . 1 . 2]" 1
156 1 15 SER H 1 18 PHE QD . . 5.100 3.976 3.679 4.488 . 0 0 "[ . 1 . 2]" 1
157 1 15 SER HA 1 16 GLY H . . 3.540 2.328 2.251 2.431 . 0 0 "[ . 1 . 2]" 1
158 1 15 SER HA 1 16 GLY HA2 . . 4.810 4.302 4.297 4.309 . 0 0 "[ . 1 . 2]" 1
159 1 15 SER HA 1 16 GLY HA3 . . 4.880 4.531 4.486 4.583 . 0 0 "[ . 1 . 2]" 1
160 1 15 SER HA 1 17 PHE H . . 5.100 4.240 3.950 4.745 . 0 0 "[ . 1 . 2]" 1
161 1 15 SER HA 1 63 ALA MB . . 3.610 2.456 2.204 2.710 . 0 0 "[ . 1 . 2]" 1
162 1 15 SER QB 1 16 GLY H . . 3.850 2.872 2.349 3.478 . 0 0 "[ . 1 . 2]" 1
163 1 15 SER QB 1 17 PHE H . . 4.200 2.813 2.405 3.198 . 0 0 "[ . 1 . 2]" 1
164 1 15 SER QB 1 18 PHE H . . 4.730 3.069 2.506 3.898 . 0 0 "[ . 1 . 2]" 1
165 1 15 SER QB 1 63 ALA MB . . 4.480 4.029 3.773 4.368 . 0 0 "[ . 1 . 2]" 1
166 1 15 SER HB2 1 16 GLY H . . 4.600 3.624 2.386 4.107 . 0 0 "[ . 1 . 2]" 1
167 1 15 SER HB2 1 17 PHE H . . 5.060 3.644 2.915 4.658 . 0 0 "[ . 1 . 2]" 1
168 1 15 SER HB2 1 18 PHE H . . 5.500 3.737 2.765 4.658 . 0 0 "[ . 1 . 2]" 1
169 1 15 SER HB2 1 63 ALA MB . . 5.110 4.618 4.136 5.110 0.000 5 0 "[ . 1 . 2]" 1
170 1 15 SER HB3 1 16 GLY H . . 4.600 3.281 2.381 4.101 . 0 0 "[ . 1 . 2]" 1
171 1 15 SER HB3 1 17 PHE H . . 5.060 3.270 2.448 4.954 . 0 0 "[ . 1 . 2]" 1
172 1 15 SER HB3 1 18 PHE H . . 5.500 3.652 2.530 4.884 . 0 0 "[ . 1 . 2]" 1
173 1 15 SER HB3 1 63 ALA MB . . 5.110 4.504 3.979 5.073 . 0 0 "[ . 1 . 2]" 1
174 1 16 GLY H 1 17 PHE H . . 4.470 2.969 2.820 3.208 . 0 0 "[ . 1 . 2]" 1
175 1 16 GLY H 1 63 ALA MB . . 3.970 2.626 2.393 3.085 . 0 0 "[ . 1 . 2]" 1
176 1 16 GLY HA2 1 17 PHE HA . . 5.230 4.756 4.663 4.873 . 0 0 "[ . 1 . 2]" 1
177 1 16 GLY HA2 1 19 LEU H . . 4.470 3.732 3.340 4.019 . 0 0 "[ . 1 . 2]" 1
178 1 16 GLY HA2 1 19 LEU QB . . 4.110 2.744 2.436 3.178 . 0 0 "[ . 1 . 2]" 1
179 1 16 GLY HA2 1 19 LEU QD . . 3.720 2.558 2.235 3.191 . 0 0 "[ . 1 . 2]" 1
180 1 16 GLY HA2 1 19 LEU HG . . 5.300 4.334 2.942 5.261 . 0 0 "[ . 1 . 2]" 1
181 1 16 GLY HA2 1 20 PHE H . . 5.370 4.171 3.935 4.420 . 0 0 "[ . 1 . 2]" 1
182 1 16 GLY HA2 1 48 TRP HH2 . . 4.740 4.270 3.911 4.731 . 0 0 "[ . 1 . 2]" 1
183 1 16 GLY HA2 1 59 TYR HA . . 5.220 4.181 3.895 4.311 . 0 0 "[ . 1 . 2]" 1
184 1 16 GLY HA2 1 59 TYR HB2 . . 4.720 4.563 4.342 4.719 . 0 0 "[ . 1 . 2]" 1
185 1 16 GLY HA2 1 59 TYR QD . . 4.870 4.316 3.845 4.631 . 0 0 "[ . 1 . 2]" 1
186 1 16 GLY HA2 1 60 ILE H . . 5.500 4.822 4.415 5.083 . 0 0 "[ . 1 . 2]" 1
187 1 16 GLY HA2 1 60 ILE HG13 . . 5.110 4.693 4.132 4.945 . 0 0 "[ . 1 . 2]" 1
188 1 16 GLY HA2 1 63 ALA H . . 4.620 4.242 3.897 4.585 . 0 0 "[ . 1 . 2]" 1
189 1 16 GLY HA2 1 63 ALA MB . . 3.350 3.053 2.609 3.344 . 0 0 "[ . 1 . 2]" 1
190 1 16 GLY HA3 1 19 LEU QB . . 4.930 4.298 3.987 4.733 . 0 0 "[ . 1 . 2]" 1
191 1 16 GLY HA3 1 19 LEU QD . . 4.700 3.923 3.680 4.444 . 0 0 "[ . 1 . 2]" 1
192 1 16 GLY HA3 1 20 PHE H . . 5.500 5.188 4.925 5.461 . 0 0 "[ . 1 . 2]" 1
193 1 16 GLY HA3 1 48 TRP HH2 . . 4.440 3.049 2.707 3.402 . 0 0 "[ . 1 . 2]" 1
194 1 16 GLY HA3 1 48 TRP HZ2 . . 5.110 4.261 3.963 4.676 . 0 0 "[ . 1 . 2]" 1
195 1 16 GLY HA3 1 59 TYR HA . . 5.240 4.894 4.579 5.240 0.000 10 0 "[ . 1 . 2]" 1
196 1 16 GLY HA3 1 59 TYR HB2 . . 4.530 4.264 4.054 4.529 . 0 0 "[ . 1 . 2]" 1
197 1 16 GLY HA3 1 59 TYR QD . . 5.500 5.118 4.751 5.473 . 0 0 "[ . 1 . 2]" 1
198 1 16 GLY HA3 1 60 ILE H . . 5.410 4.348 4.093 4.626 . 0 0 "[ . 1 . 2]" 1
199 1 16 GLY HA3 1 60 ILE HA . . 3.870 2.700 2.397 2.881 . 0 0 "[ . 1 . 2]" 1
200 1 16 GLY HA3 1 60 ILE MD . . 4.580 4.446 4.092 4.575 . 0 0 "[ . 1 . 2]" 1
201 1 16 GLY HA3 1 60 ILE HG12 . . 3.720 3.047 2.594 3.286 . 0 0 "[ . 1 . 2]" 1
202 1 16 GLY HA3 1 60 ILE HG13 . . 4.860 3.412 3.083 3.609 . 0 0 "[ . 1 . 2]" 1
203 1 16 GLY HA3 1 60 ILE MG . . 5.250 4.085 3.677 4.249 . 0 0 "[ . 1 . 2]" 1
204 1 16 GLY HA3 1 63 ALA MB . . 3.950 3.635 3.272 3.934 . 0 0 "[ . 1 . 2]" 1
205 1 17 PHE H 1 17 PHE HB2 . . 3.770 2.874 2.675 2.996 . 0 0 "[ . 1 . 2]" 1
206 1 17 PHE H 1 17 PHE QB . . 3.300 2.182 2.141 2.262 . 0 0 "[ . 1 . 2]" 1
207 1 17 PHE H 1 17 PHE HB3 . . 3.770 2.266 2.195 2.440 . 0 0 "[ . 1 . 2]" 1
208 1 17 PHE H 1 17 PHE QD . . 4.810 4.096 3.930 4.185 . 0 0 "[ . 1 . 2]" 1
209 1 17 PHE H 1 18 PHE H . . 4.060 2.597 2.351 2.978 . 0 0 "[ . 1 . 2]" 1
210 1 17 PHE H 1 48 TRP HZ2 . . 5.000 3.954 3.504 4.658 . 0 0 "[ . 1 . 2]" 1
211 1 17 PHE H 1 60 ILE HG12 . . 5.500 4.952 4.438 5.319 . 0 0 "[ . 1 . 2]" 1
212 1 17 PHE H 1 63 ALA MB . . 5.500 4.888 4.571 5.209 . 0 0 "[ . 1 . 2]" 1
213 1 17 PHE HA 1 17 PHE QD . . 3.330 2.477 2.192 3.244 . 0 0 "[ . 1 . 2]" 1
214 1 17 PHE HA 1 17 PHE QE . . 5.050 4.698 4.519 5.016 . 0 0 "[ . 1 . 2]" 1
215 1 17 PHE HA 1 20 PHE H . . 4.060 4.013 3.814 4.066 0.006 17 0 "[ . 1 . 2]" 1
216 1 17 PHE HA 1 20 PHE QD . . 4.960 4.067 3.187 4.504 . 0 0 "[ . 1 . 2]" 1
217 1 17 PHE HA 1 21 CYS H . . 4.920 4.362 3.884 4.622 . 0 0 "[ . 1 . 2]" 1
218 1 17 PHE HA 1 48 TRP HE3 . . 4.810 3.179 2.725 3.733 . 0 0 "[ . 1 . 2]" 1
219 1 17 PHE HA 1 48 TRP HH2 . . 4.800 3.630 3.208 4.104 . 0 0 "[ . 1 . 2]" 1
220 1 17 PHE HA 1 48 TRP HZ2 . . 5.040 3.939 3.248 4.726 . 0 0 "[ . 1 . 2]" 1
221 1 17 PHE HA 1 48 TRP HZ3 . . 5.090 3.238 2.760 3.770 . 0 0 "[ . 1 . 2]" 1
222 1 17 PHE QB 1 18 PHE H . . 3.850 2.764 2.579 3.047 . 0 0 "[ . 1 . 2]" 1
223 1 17 PHE QB 1 48 TRP HE1 . . 4.630 3.022 2.182 3.770 . 0 0 "[ . 1 . 2]" 1
224 1 17 PHE QB 1 48 TRP HZ2 . . 4.780 3.273 2.785 3.957 . 0 0 "[ . 1 . 2]" 1
225 1 17 PHE HB2 1 18 PHE H . . 4.520 4.085 3.967 4.271 . 0 0 "[ . 1 . 2]" 1
226 1 17 PHE HB2 1 48 TRP HZ2 . . 5.500 3.357 2.825 4.143 . 0 0 "[ . 1 . 2]" 1
227 1 17 PHE HB3 1 18 PHE H . . 4.520 2.812 2.613 3.120 . 0 0 "[ . 1 . 2]" 1
228 1 17 PHE HB3 1 48 TRP HZ2 . . 5.500 4.572 4.211 5.443 . 0 0 "[ . 1 . 2]" 1
229 1 17 PHE QD 1 18 PHE H . . 4.820 3.693 2.361 4.232 . 0 0 "[ . 1 . 2]" 1
230 1 17 PHE QD 1 48 TRP H . . 5.180 4.737 4.202 5.147 . 0 0 "[ . 1 . 2]" 1
231 1 17 PHE QD 1 48 TRP QB . . 4.160 2.248 1.992 2.539 . 0 0 "[ . 1 . 2]" 1
232 1 17 PHE QD 1 48 TRP HD1 . . 5.150 3.863 3.433 4.502 . 0 0 "[ . 1 . 2]" 1
233 1 17 PHE QE 1 44 LEU HA . . 5.030 4.633 4.131 5.010 . 0 0 "[ . 1 . 2]" 1
234 1 17 PHE QE 1 44 LEU HB2 . . 5.090 4.158 3.727 4.565 . 0 0 "[ . 1 . 2]" 1
235 1 17 PHE QE 1 44 LEU HB3 . . 4.810 3.081 2.715 3.418 . 0 0 "[ . 1 . 2]" 1
236 1 17 PHE QE 1 44 LEU MD2 . . 4.760 4.347 3.924 4.740 . 0 0 "[ . 1 . 2]" 1
237 1 17 PHE QE 1 45 GLY H . . 4.580 3.950 3.663 4.333 . 0 0 "[ . 1 . 2]" 1
238 1 17 PHE QE 1 45 GLY HA2 . . 3.760 2.627 2.161 3.000 . 0 0 "[ . 1 . 2]" 1
239 1 17 PHE QE 1 45 GLY HA3 . . 4.840 4.149 3.698 4.425 . 0 0 "[ . 1 . 2]" 1
240 1 17 PHE QE 1 48 TRP H . . 4.410 4.016 3.052 4.348 . 0 0 "[ . 1 . 2]" 1
241 1 17 PHE QE 1 48 TRP QB . . 3.870 2.514 1.977 3.084 . 0 0 "[ . 1 . 2]" 1
242 1 17 PHE HZ 1 44 LEU HB2 . . 5.430 4.181 3.615 4.630 . 0 0 "[ . 1 . 2]" 1
243 1 17 PHE HZ 1 44 LEU HB3 . . 5.500 3.879 3.155 4.359 . 0 0 "[ . 1 . 2]" 1
244 1 17 PHE HZ 1 45 GLY H . . 4.920 3.945 3.274 4.505 . 0 0 "[ . 1 . 2]" 1
245 1 17 PHE HZ 1 45 GLY HA2 . . 4.310 3.066 2.122 4.040 . 0 0 "[ . 1 . 2]" 1
246 1 17 PHE HZ 1 45 GLY HA3 . . 5.190 4.036 3.206 4.945 . 0 0 "[ . 1 . 2]" 1
247 1 18 PHE H 1 18 PHE HB2 . . 3.380 2.612 2.415 2.820 . 0 0 "[ . 1 . 2]" 1
248 1 18 PHE H 1 18 PHE HB3 . . 3.470 2.494 2.366 2.649 . 0 0 "[ . 1 . 2]" 1
249 1 18 PHE HA 1 18 PHE QD . . 3.980 3.058 2.765 3.203 . 0 0 "[ . 1 . 2]" 1
250 1 18 PHE HA 1 21 CYS H . . 4.000 3.289 2.990 3.879 . 0 0 "[ . 1 . 2]" 1
251 1 18 PHE HA 1 21 CYS HB2 . . 4.040 3.462 2.185 4.045 0.005 8 0 "[ . 1 . 2]" 1
252 1 18 PHE HA 1 21 CYS QB . . 3.360 2.578 2.169 2.785 . 0 0 "[ . 1 . 2]" 1
253 1 18 PHE HA 1 21 CYS HB3 . . 4.040 3.118 2.563 4.044 0.004 17 0 "[ . 1 . 2]" 1
254 1 18 PHE HA 1 21 CYS HG . . 4.600 3.000 2.010 4.270 . 0 0 "[ . 1 . 2]" 1
255 1 18 PHE HB2 1 19 LEU H . . 4.270 3.768 3.595 4.124 . 0 0 "[ . 1 . 2]" 1
256 1 18 PHE HB3 1 19 LEU H . . 3.960 2.390 2.090 3.064 . 0 0 "[ . 1 . 2]" 1
257 1 18 PHE HB3 1 19 LEU QD . . 4.990 3.541 2.575 4.246 . 0 0 "[ . 1 . 2]" 1
258 1 18 PHE QD 1 19 LEU H . . 4.910 3.006 2.507 3.804 . 0 0 "[ . 1 . 2]" 1
259 1 18 PHE QD 1 19 LEU HA . . 4.500 2.736 2.358 3.182 . 0 0 "[ . 1 . 2]" 1
260 1 18 PHE QD 1 19 LEU QD . . 3.840 2.885 1.978 3.505 . 0 0 "[ . 1 . 2]" 1
261 1 18 PHE QE 1 19 LEU QD . . 4.610 4.122 3.698 4.531 . 0 0 "[ . 1 . 2]" 1
262 1 19 LEU H 1 19 LEU HB2 . . 3.810 2.410 2.166 2.700 . 0 0 "[ . 1 . 2]" 1
263 1 19 LEU H 1 19 LEU QB . . 3.320 2.373 2.146 2.626 . 0 0 "[ . 1 . 2]" 1
264 1 19 LEU H 1 19 LEU HB3 . . 3.810 3.572 3.483 3.612 . 0 0 "[ . 1 . 2]" 1
265 1 19 LEU H 1 19 LEU MD1 . . 4.200 2.958 1.931 4.172 . 0 0 "[ . 1 . 2]" 1
266 1 19 LEU H 1 19 LEU QD . . 3.560 2.666 1.926 3.210 . 0 0 "[ . 1 . 2]" 1
267 1 19 LEU H 1 19 LEU MD2 . . 4.200 3.579 2.203 3.971 . 0 0 "[ . 1 . 2]" 1
268 1 19 LEU H 1 19 LEU HG . . 3.970 2.883 1.902 3.916 . 0 0 "[ . 1 . 2]" 1
269 1 19 LEU HA 1 19 LEU QD . . 2.700 2.283 1.983 2.616 . 0 0 "[ . 1 . 2]" 1
270 1 19 LEU HA 1 19 LEU HG . . 3.690 2.780 2.421 3.677 . 0 0 "[ . 1 . 2]" 1
271 1 19 LEU HA 1 21 CYS H . . 4.910 4.455 4.253 4.568 . 0 0 "[ . 1 . 2]" 1
272 1 19 LEU HA 1 22 SER H . . 3.810 3.711 3.366 3.802 . 0 0 "[ . 1 . 2]" 1
273 1 19 LEU HA 1 22 SER HB2 . . 4.110 3.858 3.560 4.116 0.006 17 0 "[ . 1 . 2]" 1
274 1 19 LEU HA 1 22 SER QB . . 3.530 3.243 3.089 3.445 . 0 0 "[ . 1 . 2]" 1
275 1 19 LEU HA 1 22 SER HB3 . . 4.110 3.496 3.314 3.709 . 0 0 "[ . 1 . 2]" 1
276 1 19 LEU HA 1 23 GLU H . . 4.640 4.482 4.198 4.645 0.005 8 0 "[ . 1 . 2]" 1
277 1 19 LEU HA 1 23 GLU HB2 . . 5.500 5.011 4.528 5.498 . 0 0 "[ . 1 . 2]" 1
278 1 19 LEU QB 1 19 LEU QD . . 2.740 1.897 1.831 1.969 . 0 0 "[ . 1 . 2]" 1
279 1 19 LEU QB 1 20 PHE H . . 3.490 2.463 2.057 2.716 . 0 0 "[ . 1 . 2]" 1
280 1 19 LEU QB 1 20 PHE HA . . 5.200 3.828 3.666 3.931 . 0 0 "[ . 1 . 2]" 1
281 1 19 LEU QB 1 59 TYR HB3 . . 4.800 3.824 2.803 4.244 . 0 0 "[ . 1 . 2]" 1
282 1 19 LEU QB 1 59 TYR QE . . 4.670 4.091 3.502 4.569 . 0 0 "[ . 1 . 2]" 1
283 1 19 LEU QB 1 62 LYS QG . . 5.180 4.575 3.283 5.090 . 0 0 "[ . 1 . 2]" 1
284 1 19 LEU QB 1 63 ALA MB . . 4.650 4.166 3.630 4.440 . 0 0 "[ . 1 . 2]" 1
285 1 19 LEU HB2 1 20 PHE H . . 4.190 2.551 2.095 2.870 . 0 0 "[ . 1 . 2]" 1
286 1 19 LEU HB2 1 59 TYR QD . . 4.010 3.454 3.009 3.690 . 0 0 "[ . 1 . 2]" 1
287 1 19 LEU HB2 1 59 TYR QE . . 5.350 5.030 4.321 5.343 . 0 0 "[ . 1 . 2]" 1
288 1 19 LEU HB2 1 63 ALA MB . . 5.500 4.365 3.759 4.694 . 0 0 "[ . 1 . 2]" 1
289 1 19 LEU HB3 1 20 PHE H . . 4.190 3.302 2.645 3.646 . 0 0 "[ . 1 . 2]" 1
290 1 19 LEU HB3 1 59 TYR QD . . 4.010 3.345 2.010 3.896 . 0 0 "[ . 1 . 2]" 1
291 1 19 LEU HB3 1 59 TYR QE . . 5.350 4.354 3.590 4.989 . 0 0 "[ . 1 . 2]" 1
292 1 19 LEU HB3 1 63 ALA MB . . 5.500 5.278 4.797 5.502 0.002 10 0 "[ . 1 . 2]" 1
293 1 19 LEU QD 1 20 PHE H . . 5.070 3.895 3.598 4.167 . 0 0 "[ . 1 . 2]" 1
294 1 19 LEU QD 1 22 SER H . . 5.240 5.126 4.614 5.238 . 0 0 "[ . 1 . 2]" 1
295 1 19 LEU QD 1 22 SER QB . . 4.530 4.228 3.815 4.531 0.001 16 0 "[ . 1 . 2]" 1
296 1 19 LEU QD 1 59 TYR HA . . 3.940 3.674 3.330 3.884 . 0 0 "[ . 1 . 2]" 1
297 1 19 LEU QD 1 59 TYR HB2 . . 5.440 5.357 5.114 5.442 0.002 8 0 "[ . 1 . 2]" 1
298 1 19 LEU QD 1 59 TYR HB3 . . 4.940 4.157 3.966 4.316 . 0 0 "[ . 1 . 2]" 1
299 1 19 LEU QD 1 59 TYR QD . . 4.210 3.591 3.153 3.920 . 0 0 "[ . 1 . 2]" 1
300 1 19 LEU QD 1 62 LYS H . . 4.510 4.183 3.790 4.495 . 0 0 "[ . 1 . 2]" 1
301 1 19 LEU QD 1 62 LYS HA . . 5.080 4.344 3.948 4.759 . 0 0 "[ . 1 . 2]" 1
302 1 19 LEU QD 1 62 LYS QB . . 3.090 2.253 1.953 2.789 . 0 0 "[ . 1 . 2]" 1
303 1 19 LEU QD 1 62 LYS QD . . 3.490 2.550 1.871 3.483 . 0 0 "[ . 1 . 2]" 1
304 1 19 LEU QD 1 62 LYS QE . . 4.360 2.830 1.791 4.246 . 0 0 "[ . 1 . 2]" 1
305 1 19 LEU QD 1 62 LYS QG . . 3.360 2.549 1.837 3.355 . 0 0 "[ . 1 . 2]" 1
306 1 19 LEU QD 1 63 ALA H . . 3.540 2.854 2.327 3.496 . 0 0 "[ . 1 . 2]" 1
307 1 19 LEU QD 1 63 ALA HA . . 3.390 2.575 1.987 2.988 . 0 0 "[ . 1 . 2]" 1
308 1 19 LEU QD 1 63 ALA MB . . 3.080 2.222 1.920 2.606 . 0 0 "[ . 1 . 2]" 1
309 1 19 LEU MD1 1 59 TYR QD . . 5.320 4.246 3.338 5.317 . 0 0 "[ . 1 . 2]" 1
310 1 19 LEU MD2 1 59 TYR QD . . 5.320 4.505 3.185 5.291 . 0 0 "[ . 1 . 2]" 1
311 1 19 LEU HG 1 20 PHE H . . 5.500 4.656 4.104 5.152 . 0 0 "[ . 1 . 2]" 1
312 1 20 PHE H 1 20 PHE HB2 . . 3.410 2.931 2.776 3.034 . 0 0 "[ . 1 . 2]" 1
313 1 20 PHE H 1 20 PHE HB3 . . 3.240 2.231 2.195 2.316 . 0 0 "[ . 1 . 2]" 1
314 1 20 PHE H 1 20 PHE QD . . 4.670 3.925 3.819 4.077 . 0 0 "[ . 1 . 2]" 1
315 1 20 PHE H 1 21 CYS H . . 3.470 2.584 2.392 2.844 . 0 0 "[ . 1 . 2]" 1
316 1 20 PHE H 1 23 GLU H . . 5.500 4.709 4.552 4.934 . 0 0 "[ . 1 . 2]" 1
317 1 20 PHE H 1 23 GLU HB3 . . 5.500 4.930 4.507 5.305 . 0 0 "[ . 1 . 2]" 1
318 1 20 PHE H 1 48 TRP HZ3 . . 5.160 4.407 3.574 4.975 . 0 0 "[ . 1 . 2]" 1
319 1 20 PHE H 1 59 TYR HB3 . . 5.150 4.202 3.458 4.604 . 0 0 "[ . 1 . 2]" 1
320 1 20 PHE H 1 59 TYR QD . . 4.490 3.857 3.303 4.388 . 0 0 "[ . 1 . 2]" 1
321 1 20 PHE H 1 59 TYR QE . . 5.420 4.607 4.066 5.193 . 0 0 "[ . 1 . 2]" 1
322 1 20 PHE HA 1 20 PHE QD . . 3.730 3.184 2.823 3.309 . 0 0 "[ . 1 . 2]" 1
323 1 20 PHE HA 1 23 GLU H . . 3.970 3.340 3.119 3.643 . 0 0 "[ . 1 . 2]" 1
324 1 20 PHE HA 1 23 GLU HB2 . . 3.980 3.625 3.125 3.982 0.002 17 0 "[ . 1 . 2]" 1
325 1 20 PHE HA 1 23 GLU HB3 . . 4.180 2.445 2.185 2.960 . 0 0 "[ . 1 . 2]" 1
326 1 20 PHE HA 1 23 GLU QG . . 5.010 3.965 3.471 4.423 . 0 0 "[ . 1 . 2]" 1
327 1 20 PHE HA 1 24 PHE H . . 4.530 4.114 3.884 4.515 . 0 0 "[ . 1 . 2]" 1
328 1 20 PHE HA 1 24 PHE QD . . 4.800 3.471 3.225 4.091 . 0 0 "[ . 1 . 2]" 1
329 1 20 PHE HA 1 24 PHE QE . . 4.830 4.421 4.065 4.720 . 0 0 "[ . 1 . 2]" 1
330 1 20 PHE HA 1 59 TYR QD . . 3.970 3.824 3.467 3.971 0.001 9 0 "[ . 1 . 2]" 1
331 1 20 PHE HA 1 59 TYR QE . . 3.470 2.939 2.431 3.340 . 0 0 "[ . 1 . 2]" 1
332 1 20 PHE HB2 1 21 CYS H . . 4.130 4.117 4.092 4.133 0.003 8 0 "[ . 1 . 2]" 1
333 1 20 PHE HB2 1 48 TRP HE3 . . 4.930 3.968 3.571 4.455 . 0 0 "[ . 1 . 2]" 1
334 1 20 PHE HB2 1 48 TRP HZ3 . . 4.270 3.167 2.820 3.544 . 0 0 "[ . 1 . 2]" 1
335 1 20 PHE HB2 1 51 LEU MD1 . . 4.490 3.548 3.021 3.765 . 0 0 "[ . 1 . 2]" 1
336 1 20 PHE HB2 1 59 TYR HB3 . . 5.260 3.742 3.261 3.968 . 0 0 "[ . 1 . 2]" 1
337 1 20 PHE HB2 1 59 TYR QD . . 4.940 3.198 2.974 3.381 . 0 0 "[ . 1 . 2]" 1
338 1 20 PHE HB2 1 59 TYR QE . . 5.170 3.177 2.890 3.456 . 0 0 "[ . 1 . 2]" 1
339 1 20 PHE HB3 1 21 CYS H . . 3.540 2.858 2.817 2.888 . 0 0 "[ . 1 . 2]" 1
340 1 20 PHE HB3 1 48 TRP HE3 . . 5.140 3.091 2.529 3.479 . 0 0 "[ . 1 . 2]" 1
341 1 20 PHE HB3 1 48 TRP HZ3 . . 4.660 2.911 2.448 3.353 . 0 0 "[ . 1 . 2]" 1
342 1 20 PHE HB3 1 59 TYR QE . . 5.500 4.573 4.241 4.878 . 0 0 "[ . 1 . 2]" 1
343 1 20 PHE QD 1 21 CYS H . . 4.070 2.714 2.480 3.152 . 0 0 "[ . 1 . 2]" 1
344 1 20 PHE QD 1 21 CYS HA . . 4.790 2.855 2.526 3.774 . 0 0 "[ . 1 . 2]" 1
345 1 20 PHE QD 1 44 LEU MD2 . . 4.430 3.618 3.305 4.394 . 0 0 "[ . 1 . 2]" 1
346 1 20 PHE QD 1 48 TRP HA . . 5.140 4.130 3.277 4.602 . 0 0 "[ . 1 . 2]" 1
347 1 20 PHE QD 1 48 TRP QB . . 5.500 3.503 2.925 4.026 . 0 0 "[ . 1 . 2]" 1
348 1 20 PHE QD 1 48 TRP HE3 . . 5.480 3.067 2.016 3.485 . 0 0 "[ . 1 . 2]" 1
349 1 20 PHE QD 1 51 LEU MD1 . . 4.750 2.768 2.472 3.096 . 0 0 "[ . 1 . 2]" 1
350 1 20 PHE QD 1 59 TYR QE . . 4.420 2.898 2.643 3.144 . 0 0 "[ . 1 . 2]" 1
351 1 20 PHE QE 1 44 LEU HA . . 4.900 3.411 3.016 4.331 . 0 0 "[ . 1 . 2]" 1
352 1 20 PHE QE 1 44 LEU MD2 . . 4.590 2.999 2.611 3.948 . 0 0 "[ . 1 . 2]" 1
353 1 20 PHE QE 1 47 MET HA . . 5.500 4.792 4.565 5.001 . 0 0 "[ . 1 . 2]" 1
354 1 20 PHE QE 1 48 TRP H . . 4.580 3.350 2.475 3.687 . 0 0 "[ . 1 . 2]" 1
355 1 20 PHE QE 1 48 TRP HA . . 4.490 3.604 2.166 4.217 . 0 0 "[ . 1 . 2]" 1
356 1 20 PHE QE 1 51 LEU MD1 . . 4.020 2.747 2.461 3.061 . 0 0 "[ . 1 . 2]" 1
357 1 20 PHE QE 1 51 LEU MD2 . . 3.830 2.853 2.062 3.285 . 0 0 "[ . 1 . 2]" 1
358 1 20 PHE HZ 1 44 LEU HA . . 5.230 4.904 4.466 5.227 . 0 0 "[ . 1 . 2]" 1
359 1 20 PHE HZ 1 44 LEU MD2 . . 5.010 4.458 4.158 4.701 . 0 0 "[ . 1 . 2]" 1
360 1 20 PHE HZ 1 47 MET H . . 5.500 5.311 5.065 5.481 . 0 0 "[ . 1 . 2]" 1
361 1 20 PHE HZ 1 47 MET HA . . 4.880 4.303 4.015 4.504 . 0 0 "[ . 1 . 2]" 1
362 1 20 PHE HZ 1 47 MET HB2 . . 3.790 2.789 2.531 3.033 . 0 0 "[ . 1 . 2]" 1
363 1 20 PHE HZ 1 47 MET HB3 . . 3.650 2.091 2.002 2.262 . 0 0 "[ . 1 . 2]" 1
364 1 20 PHE HZ 1 47 MET ME . . 4.300 2.396 1.971 3.604 . 0 0 "[ . 1 . 2]" 1
365 1 20 PHE HZ 1 47 MET HG2 . . 4.850 4.522 4.078 4.778 . 0 0 "[ . 1 . 2]" 1
366 1 20 PHE HZ 1 47 MET HG3 . . 4.850 4.561 4.295 4.846 . 0 0 "[ . 1 . 2]" 1
367 1 20 PHE HZ 1 48 TRP H . . 4.750 4.525 3.970 4.743 . 0 0 "[ . 1 . 2]" 1
368 1 20 PHE HZ 1 48 TRP HA . . 4.800 4.336 3.697 4.800 . 0 0 "[ . 1 . 2]" 1
369 1 20 PHE HZ 1 51 LEU MD1 . . 4.570 3.309 2.928 3.536 . 0 0 "[ . 1 . 2]" 1
370 1 20 PHE HZ 1 51 LEU MD2 . . 4.570 3.987 3.452 4.375 . 0 0 "[ . 1 . 2]" 1
371 1 21 CYS H 1 21 CYS HB2 . . 3.930 3.090 2.200 3.545 . 0 0 "[ . 1 . 2]" 1
372 1 21 CYS H 1 21 CYS QB . . 3.310 2.235 2.179 2.322 . 0 0 "[ . 1 . 2]" 1
373 1 21 CYS H 1 21 CYS HB3 . . 3.930 2.706 2.217 3.570 . 0 0 "[ . 1 . 2]" 1
374 1 21 CYS H 1 21 CYS HG . . 3.930 3.361 2.889 3.926 . 0 0 "[ . 1 . 2]" 1
375 1 21 CYS H 1 22 SER H . . 3.430 2.669 2.452 2.921 . 0 0 "[ . 1 . 2]" 1
376 1 21 CYS H 1 23 GLU H . . 4.880 3.867 3.703 3.993 . 0 0 "[ . 1 . 2]" 1
377 1 21 CYS H 1 44 LEU MD2 . . 4.850 4.211 3.981 4.450 . 0 0 "[ . 1 . 2]" 1
378 1 21 CYS HA 1 23 GLU H . . 4.890 4.069 3.751 4.218 . 0 0 "[ . 1 . 2]" 1
379 1 21 CYS HA 1 24 PHE H . . 4.200 3.478 3.233 3.808 . 0 0 "[ . 1 . 2]" 1
380 1 21 CYS HA 1 24 PHE HB2 . . 4.310 3.041 2.784 3.646 . 0 0 "[ . 1 . 2]" 1
381 1 21 CYS HA 1 25 ARG H . . 4.290 4.140 3.992 4.295 0.005 18 0 "[ . 1 . 2]" 1
382 1 21 CYS HA 1 44 LEU MD1 . . 3.910 3.310 2.762 3.697 . 0 0 "[ . 1 . 2]" 1
383 1 21 CYS HA 1 44 LEU MD2 . . 3.110 1.930 1.785 2.148 . 0 0 "[ . 1 . 2]" 1
384 1 21 CYS QB 1 22 SER H . . 3.530 3.110 2.231 3.481 . 0 0 "[ . 1 . 2]" 1
385 1 21 CYS QB 1 44 LEU MD1 . . 3.220 1.988 1.830 2.369 . 0 0 "[ . 1 . 2]" 1
386 1 21 CYS QB 1 44 LEU MD2 . . 3.590 2.428 1.922 2.955 . 0 0 "[ . 1 . 2]" 1
387 1 21 CYS HB2 1 22 SER H . . 4.160 3.549 2.289 4.107 . 0 0 "[ . 1 . 2]" 1
388 1 21 CYS HB3 1 22 SER H . . 4.160 3.537 2.870 3.872 . 0 0 "[ . 1 . 2]" 1
389 1 22 SER H 1 22 SER HB2 . . 3.650 2.428 2.195 3.642 . 0 0 "[ . 1 . 2]" 1
390 1 22 SER H 1 22 SER QB . . 3.190 2.259 2.138 2.641 . 0 0 "[ . 1 . 2]" 1
391 1 22 SER H 1 22 SER HB3 . . 3.650 2.796 2.640 2.949 . 0 0 "[ . 1 . 2]" 1
392 1 22 SER H 1 23 GLU H . . 3.300 2.446 2.267 2.732 . 0 0 "[ . 1 . 2]" 1
393 1 22 SER HA 1 24 PHE H . . 4.930 4.208 4.120 4.408 . 0 0 "[ . 1 . 2]" 1
394 1 22 SER HA 1 25 ARG H . . 4.750 3.409 3.282 3.526 . 0 0 "[ . 1 . 2]" 1
395 1 22 SER HA 1 25 ARG HB2 . . 4.310 2.377 1.991 2.557 . 0 0 "[ . 1 . 2]" 1
396 1 22 SER HA 1 25 ARG QB . . 3.710 2.338 1.971 2.510 . 0 0 "[ . 1 . 2]" 1
397 1 22 SER HA 1 25 ARG HB3 . . 4.310 3.465 3.172 3.656 . 0 0 "[ . 1 . 2]" 1
398 1 22 SER HA 1 25 ARG HD2 . . 5.080 4.018 2.811 4.925 . 0 0 "[ . 1 . 2]" 1
399 1 22 SER HA 1 25 ARG QD . . 4.450 3.075 2.532 3.917 . 0 0 "[ . 1 . 2]" 1
400 1 22 SER HA 1 25 ARG HD3 . . 5.080 3.622 2.550 4.974 . 0 0 "[ . 1 . 2]" 1
401 1 22 SER HA 1 26 PRO QD . . 4.680 3.709 3.478 3.907 . 0 0 "[ . 1 . 2]" 1
402 1 22 SER HB2 1 23 GLU H . . 4.070 3.915 3.772 4.029 . 0 0 "[ . 1 . 2]" 1
403 1 22 SER HB3 1 23 GLU H . . 4.070 3.155 2.939 4.072 0.002 17 0 "[ . 1 . 2]" 1
404 1 23 GLU H 1 23 GLU HB2 . . 3.240 2.844 2.585 3.069 . 0 0 "[ . 1 . 2]" 1
405 1 23 GLU H 1 23 GLU HB3 . . 3.290 2.374 2.196 2.508 . 0 0 "[ . 1 . 2]" 1
406 1 23 GLU H 1 23 GLU HG2 . . 4.600 4.380 4.012 4.603 0.003 17 0 "[ . 1 . 2]" 1
407 1 23 GLU H 1 23 GLU QG . . 4.000 3.925 3.748 4.056 0.056 18 0 "[ . 1 . 2]" 1
408 1 23 GLU H 1 23 GLU HG3 . . 4.600 4.456 4.334 4.625 0.025 18 0 "[ . 1 . 2]" 1
409 1 23 GLU H 1 24 PHE H . . 3.110 2.308 2.205 2.521 . 0 0 "[ . 1 . 2]" 1
410 1 23 GLU H 1 24 PHE QD . . 4.740 4.044 3.864 4.479 . 0 0 "[ . 1 . 2]" 1
411 1 23 GLU H 1 25 ARG H . . 4.830 3.606 3.498 3.688 . 0 0 "[ . 1 . 2]" 1
412 1 23 GLU H 1 44 LEU MD2 . . 5.320 4.810 4.552 5.126 . 0 0 "[ . 1 . 2]" 1
413 1 23 GLU HA 1 23 GLU HG2 . . 4.130 3.580 2.559 3.855 . 0 0 "[ . 1 . 2]" 1
414 1 23 GLU HA 1 23 GLU QG . . 3.390 2.634 2.368 2.880 . 0 0 "[ . 1 . 2]" 1
415 1 23 GLU HA 1 23 GLU HG3 . . 4.130 2.765 2.415 3.743 . 0 0 "[ . 1 . 2]" 1
416 1 23 GLU HA 1 26 PRO QD . . 4.480 3.246 3.146 3.384 . 0 0 "[ . 1 . 2]" 1
417 1 23 GLU HA 1 26 PRO QG . . 4.850 3.265 3.055 3.560 . 0 0 "[ . 1 . 2]" 1
418 1 23 GLU HB2 1 24 PHE H . . 4.360 4.123 3.868 4.275 . 0 0 "[ . 1 . 2]" 1
419 1 23 GLU HB2 1 24 PHE QD . . 4.610 4.389 4.252 4.573 . 0 0 "[ . 1 . 2]" 1
420 1 23 GLU HB2 1 59 TYR QE . . 4.630 4.262 3.073 4.624 . 0 0 "[ . 1 . 2]" 1
421 1 23 GLU HB3 1 24 PHE H . . 4.070 2.956 2.600 3.132 . 0 0 "[ . 1 . 2]" 1
422 1 23 GLU HB3 1 24 PHE HA . . 4.890 4.603 4.383 4.884 . 0 0 "[ . 1 . 2]" 1
423 1 23 GLU HB3 1 24 PHE QD . . 4.540 2.769 2.599 3.117 . 0 0 "[ . 1 . 2]" 1
424 1 23 GLU HB3 1 59 TYR QE . . 4.630 3.769 2.818 4.064 . 0 0 "[ . 1 . 2]" 1
425 1 23 GLU QG 1 24 PHE HA . . 5.160 3.692 3.349 4.745 . 0 0 "[ . 1 . 2]" 1
426 1 23 GLU QG 1 24 PHE QE . . 4.990 3.362 2.956 4.273 . 0 0 "[ . 1 . 2]" 1
427 1 23 GLU QG 1 27 LYS QE . . 4.550 3.815 3.333 4.549 . 0 0 "[ . 1 . 2]" 1
428 1 23 GLU HG2 1 24 PHE H . . 4.730 4.178 3.464 4.771 0.041 18 0 "[ . 1 . 2]" 1
429 1 23 GLU HG2 1 24 PHE QD . . 4.980 2.984 2.153 4.989 0.009 18 0 "[ . 1 . 2]" 1
430 1 23 GLU HG2 1 27 LYS QE . . 5.260 4.490 3.666 5.208 . 0 0 "[ . 1 . 2]" 1
431 1 23 GLU HG3 1 24 PHE H . . 4.730 4.318 3.764 4.751 0.021 18 0 "[ . 1 . 2]" 1
432 1 23 GLU HG3 1 24 PHE QD . . 4.980 3.817 2.699 4.506 . 0 0 "[ . 1 . 2]" 1
433 1 23 GLU HG3 1 27 LYS QE . . 5.260 4.296 3.558 5.197 . 0 0 "[ . 1 . 2]" 1
434 1 24 PHE H 1 24 PHE HB2 . . 3.110 2.250 2.218 2.272 . 0 0 "[ . 1 . 2]" 1
435 1 24 PHE H 1 24 PHE HB3 . . 3.660 3.509 3.493 3.531 . 0 0 "[ . 1 . 2]" 1
436 1 24 PHE H 1 24 PHE QD . . 3.720 2.765 2.668 2.831 . 0 0 "[ . 1 . 2]" 1
437 1 24 PHE H 1 25 ARG H . . 3.400 2.203 2.160 2.285 . 0 0 "[ . 1 . 2]" 1
438 1 24 PHE H 1 26 PRO QD . . 4.780 3.249 3.186 3.395 . 0 0 "[ . 1 . 2]" 1
439 1 24 PHE H 1 28 ILE MD . . 5.500 5.361 5.122 5.497 . 0 0 "[ . 1 . 2]" 1
440 1 24 PHE H 1 44 LEU MD2 . . 4.250 3.776 3.488 4.017 . 0 0 "[ . 1 . 2]" 1
441 1 24 PHE HA 1 24 PHE QD . . 3.570 2.919 2.540 3.037 . 0 0 "[ . 1 . 2]" 1
442 1 24 PHE HA 1 26 PRO QD . . 4.250 2.930 2.853 2.989 . 0 0 "[ . 1 . 2]" 1
443 1 24 PHE HA 1 26 PRO QG . . 4.440 4.287 4.187 4.370 . 0 0 "[ . 1 . 2]" 1
444 1 24 PHE HA 1 27 LYS QB . . 3.770 3.691 3.584 3.771 0.001 8 0 "[ . 1 . 2]" 1
445 1 24 PHE HA 1 27 LYS HD2 . . 4.290 2.427 2.164 2.594 . 0 0 "[ . 1 . 2]" 1
446 1 24 PHE HA 1 27 LYS QD . . 3.630 2.411 2.154 2.572 . 0 0 "[ . 1 . 2]" 1
447 1 24 PHE HA 1 27 LYS HD3 . . 4.290 4.132 3.897 4.274 . 0 0 "[ . 1 . 2]" 1
448 1 24 PHE HA 1 27 LYS QE . . 4.600 3.067 2.575 3.799 . 0 0 "[ . 1 . 2]" 1
449 1 24 PHE HA 1 27 LYS HG2 . . 5.470 4.954 4.821 5.159 . 0 0 "[ . 1 . 2]" 1
450 1 24 PHE HA 1 27 LYS HG3 . . 4.000 3.651 3.464 3.920 . 0 0 "[ . 1 . 2]" 1
451 1 24 PHE HA 1 28 ILE H . . 5.100 4.693 4.635 4.773 . 0 0 "[ . 1 . 2]" 1
452 1 24 PHE HA 1 28 ILE MD . . 5.500 5.124 4.962 5.322 . 0 0 "[ . 1 . 2]" 1
453 1 24 PHE HA 1 28 ILE HG13 . . 5.500 4.764 4.650 4.915 . 0 0 "[ . 1 . 2]" 1
454 1 24 PHE HA 1 44 LEU MD2 . . 5.040 4.831 4.524 5.041 0.001 10 0 "[ . 1 . 2]" 1
455 1 24 PHE HA 1 47 MET ME . . 4.780 4.285 4.040 4.692 . 0 0 "[ . 1 . 2]" 1
456 1 24 PHE HB2 1 25 ARG H . . 4.830 3.352 3.278 3.508 . 0 0 "[ . 1 . 2]" 1
457 1 24 PHE HB2 1 44 LEU MD2 . . 3.250 2.958 2.556 3.190 . 0 0 "[ . 1 . 2]" 1
458 1 24 PHE HB3 1 25 ARG H . . 4.680 3.822 3.747 3.931 . 0 0 "[ . 1 . 2]" 1
459 1 24 PHE HB3 1 28 ILE MD . . 4.070 3.273 3.096 3.425 . 0 0 "[ . 1 . 2]" 1
460 1 24 PHE HB3 1 28 ILE HG12 . . 4.980 4.635 4.205 4.852 . 0 0 "[ . 1 . 2]" 1
461 1 24 PHE HB3 1 28 ILE HG13 . . 5.190 3.469 3.320 3.586 . 0 0 "[ . 1 . 2]" 1
462 1 24 PHE HB3 1 44 LEU MD2 . . 3.370 3.156 2.787 3.356 . 0 0 "[ . 1 . 2]" 1
463 1 24 PHE QD 1 25 ARG H . . 5.410 4.579 4.498 4.705 . 0 0 "[ . 1 . 2]" 1
464 1 24 PHE QD 1 27 LYS HD2 . . 4.870 3.236 2.295 3.720 . 0 0 "[ . 1 . 2]" 1
465 1 24 PHE QD 1 27 LYS HD3 . . 4.870 3.932 2.957 4.550 . 0 0 "[ . 1 . 2]" 1
466 1 24 PHE QD 1 27 LYS QE . . 5.250 3.985 3.223 4.735 . 0 0 "[ . 1 . 2]" 1
467 1 24 PHE QD 1 28 ILE MD . . 4.380 4.343 4.213 4.385 0.005 18 0 "[ . 1 . 2]" 1
468 1 24 PHE QD 1 28 ILE HG12 . . 5.350 5.144 4.822 5.350 0.000 3 0 "[ . 1 . 2]" 1
469 1 24 PHE QD 1 44 LEU MD2 . . 4.970 4.302 3.758 4.483 . 0 0 "[ . 1 . 2]" 1
470 1 24 PHE QD 1 47 MET ME . . 3.070 2.048 1.864 2.385 . 0 0 "[ . 1 . 2]" 1
471 1 24 PHE QE 1 27 LYS HD2 . . 5.500 4.271 3.718 4.564 . 0 0 "[ . 1 . 2]" 1
472 1 24 PHE QE 1 27 LYS QD . . 4.720 3.816 3.111 4.193 . 0 0 "[ . 1 . 2]" 1
473 1 24 PHE QE 1 27 LYS HD3 . . 5.500 4.307 3.336 4.888 . 0 0 "[ . 1 . 2]" 1
474 1 24 PHE QE 1 27 LYS QE . . 5.300 4.129 3.322 4.816 . 0 0 "[ . 1 . 2]" 1
475 1 24 PHE QE 1 47 MET ME . . 3.830 3.565 3.140 3.808 . 0 0 "[ . 1 . 2]" 1
476 1 24 PHE HZ 1 27 LYS QD . . 5.340 4.939 4.701 5.050 . 0 0 "[ . 1 . 2]" 1
477 1 24 PHE HZ 1 27 LYS QE . . 5.500 4.753 3.969 5.472 . 0 0 "[ . 1 . 2]" 1
478 1 24 PHE HZ 1 47 MET ME . . 5.500 5.100 4.817 5.454 . 0 0 "[ . 1 . 2]" 1
479 1 25 ARG H 1 25 ARG HB2 . . 3.460 2.164 2.146 2.178 . 0 0 "[ . 1 . 2]" 1
480 1 25 ARG H 1 25 ARG HB3 . . 3.460 2.965 2.935 3.007 . 0 0 "[ . 1 . 2]" 1
481 1 25 ARG H 1 25 ARG HG2 . . 4.780 4.563 4.469 4.627 . 0 0 "[ . 1 . 2]" 1
482 1 25 ARG H 1 25 ARG HG3 . . 5.160 4.067 4.005 4.123 . 0 0 "[ . 1 . 2]" 1
483 1 25 ARG H 1 26 PRO QD . . 3.470 2.146 2.081 2.206 . 0 0 "[ . 1 . 2]" 1
484 1 25 ARG H 1 26 PRO QG . . 5.050 4.047 3.979 4.114 . 0 0 "[ . 1 . 2]" 1
485 1 25 ARG H 1 27 LYS H . . 5.210 4.581 4.483 4.708 . 0 0 "[ . 1 . 2]" 1
486 1 25 ARG H 1 28 ILE H . . 5.360 5.142 5.007 5.271 . 0 0 "[ . 1 . 2]" 1
487 1 25 ARG H 1 28 ILE MD . . 5.140 4.485 4.263 4.818 . 0 0 "[ . 1 . 2]" 1
488 1 25 ARG H 1 44 LEU MD1 . . 4.850 4.454 3.885 4.807 . 0 0 "[ . 1 . 2]" 1
489 1 25 ARG H 1 44 LEU MD2 . . 3.950 3.368 3.015 3.618 . 0 0 "[ . 1 . 2]" 1
490 1 25 ARG HA 1 25 ARG HD2 . . 5.160 4.475 3.973 4.663 . 0 0 "[ . 1 . 2]" 1
491 1 25 ARG HA 1 25 ARG QD . . 4.480 3.935 3.734 4.099 . 0 0 "[ . 1 . 2]" 1
492 1 25 ARG HA 1 25 ARG HD3 . . 5.160 4.404 4.037 4.692 . 0 0 "[ . 1 . 2]" 1
493 1 25 ARG HA 1 25 ARG HG2 . . 3.770 2.868 2.572 3.103 . 0 0 "[ . 1 . 2]" 1
494 1 25 ARG HA 1 25 ARG HG3 . . 3.470 2.351 2.191 2.608 . 0 0 "[ . 1 . 2]" 1
495 1 25 ARG HA 1 27 LYS H . . 4.730 4.569 4.414 4.730 . 0 0 "[ . 1 . 2]" 1
496 1 25 ARG HA 1 28 ILE H . . 4.320 3.669 3.476 3.839 . 0 0 "[ . 1 . 2]" 1
497 1 25 ARG HA 1 28 ILE HB . . 3.450 2.918 2.748 3.062 . 0 0 "[ . 1 . 2]" 1
498 1 25 ARG HA 1 28 ILE MD . . 3.740 2.775 2.407 3.139 . 0 0 "[ . 1 . 2]" 1
499 1 25 ARG HA 1 29 LYS HG3 . . 4.270 3.927 3.616 4.216 . 0 0 "[ . 1 . 2]" 1
500 1 25 ARG HA 1 40 VAL MG1 . . 3.520 2.933 2.678 3.197 . 0 0 "[ . 1 . 2]" 1
501 1 25 ARG HA 1 44 LEU MD1 . . 4.040 3.790 3.466 4.041 0.001 4 0 "[ . 1 . 2]" 1
502 1 25 ARG HA 1 44 LEU MD2 . . 3.540 3.094 2.691 3.366 . 0 0 "[ . 1 . 2]" 1
503 1 25 ARG QB 1 25 ARG QD . . 3.240 2.219 2.102 2.354 . 0 0 "[ . 1 . 2]" 1
504 1 25 ARG QB 1 26 PRO QD . . 3.440 1.923 1.908 1.925 . 0 0 "[ . 1 . 2]" 1
505 1 25 ARG QB 1 44 LEU MD1 . . 4.070 3.478 2.978 3.750 . 0 0 "[ . 1 . 2]" 1
506 1 25 ARG HB2 1 26 PRO QD . . 4.170 2.760 2.728 2.763 . 0 0 "[ . 1 . 2]" 1
507 1 25 ARG HB3 1 26 PRO QD . . 4.170 1.962 1.948 1.965 . 0 0 "[ . 1 . 2]" 1
508 1 25 ARG QD 1 40 VAL MG1 . . 3.720 3.032 2.616 3.705 . 0 0 "[ . 1 . 2]" 1
509 1 25 ARG QD 1 44 LEU MD1 . . 4.510 3.272 2.664 4.086 . 0 0 "[ . 1 . 2]" 1
510 1 25 ARG HD2 1 40 VAL MG1 . . 4.280 3.441 2.717 4.274 . 0 0 "[ . 1 . 2]" 1
511 1 25 ARG HD2 1 44 LEU MD1 . . 5.160 3.819 2.855 5.056 . 0 0 "[ . 1 . 2]" 1
512 1 25 ARG HD3 1 40 VAL MG1 . . 4.280 3.618 2.906 4.227 . 0 0 "[ . 1 . 2]" 1
513 1 25 ARG HD3 1 44 LEU MD1 . . 5.160 3.780 2.941 5.136 . 0 0 "[ . 1 . 2]" 1
514 1 25 ARG HG2 1 26 PRO HA . . 4.860 4.769 4.743 4.856 . 0 0 "[ . 1 . 2]" 1
515 1 25 ARG HG2 1 40 VAL MG1 . . 3.980 2.777 2.136 3.263 . 0 0 "[ . 1 . 2]" 1
516 1 25 ARG HG2 1 44 LEU MD1 . . 4.720 4.283 3.866 4.722 0.002 20 0 "[ . 1 . 2]" 1
517 1 25 ARG HG3 1 40 VAL MG1 . . 3.220 1.964 1.813 2.190 . 0 0 "[ . 1 . 2]" 1
518 1 25 ARG HG3 1 44 LEU MD1 . . 4.180 2.781 2.295 3.242 . 0 0 "[ . 1 . 2]" 1
519 1 26 PRO HA 1 28 ILE H . . 5.500 4.924 4.703 5.067 . 0 0 "[ . 1 . 2]" 1
520 1 26 PRO HA 1 29 LYS H . . 4.180 3.893 3.693 4.181 0.001 7 0 "[ . 1 . 2]" 1
521 1 26 PRO HA 1 29 LYS HB2 . . 3.400 3.029 2.671 3.370 . 0 0 "[ . 1 . 2]" 1
522 1 26 PRO HA 1 29 LYS HB3 . . 5.200 4.643 4.227 5.068 . 0 0 "[ . 1 . 2]" 1
523 1 26 PRO HA 1 29 LYS HD3 . . 4.860 4.049 3.408 4.664 . 0 0 "[ . 1 . 2]" 1
524 1 26 PRO HA 1 29 LYS HG3 . . 4.520 3.999 3.064 4.514 . 0 0 "[ . 1 . 2]" 1
525 1 26 PRO HA 1 30 SER H . . 4.860 4.599 4.384 4.862 0.002 16 0 "[ . 1 . 2]" 1
526 1 26 PRO QB 1 27 LYS H . . 3.620 2.234 2.113 2.354 . 0 0 "[ . 1 . 2]" 1
527 1 26 PRO QB 1 27 LYS HA . . 4.870 3.728 3.694 3.764 . 0 0 "[ . 1 . 2]" 1
528 1 26 PRO QD 1 27 LYS H . . 3.540 2.962 2.932 2.998 . 0 0 "[ . 1 . 2]" 1
529 1 26 PRO QG 1 27 LYS H . . 3.710 3.620 3.568 3.674 . 0 0 "[ . 1 . 2]" 1
530 1 26 PRO QG 1 27 LYS HG3 . . 4.560 4.322 4.216 4.454 . 0 0 "[ . 1 . 2]" 1
531 1 27 LYS H 1 27 LYS QB . . 2.940 2.516 2.447 2.587 . 0 0 "[ . 1 . 2]" 1
532 1 27 LYS H 1 27 LYS QD . . 4.420 3.269 3.130 3.389 . 0 0 "[ . 1 . 2]" 1
533 1 27 LYS H 1 27 LYS QE . . 5.500 3.916 3.579 4.415 . 0 0 "[ . 1 . 2]" 1
534 1 27 LYS H 1 27 LYS HG2 . . 4.010 3.543 3.391 3.675 . 0 0 "[ . 1 . 2]" 1
535 1 27 LYS H 1 27 LYS HG3 . . 3.570 2.057 1.905 2.215 . 0 0 "[ . 1 . 2]" 1
536 1 27 LYS H 1 28 ILE H . . 3.170 2.850 2.710 2.976 . 0 0 "[ . 1 . 2]" 1
537 1 27 LYS H 1 28 ILE HA . . 5.500 5.403 5.304 5.491 . 0 0 "[ . 1 . 2]" 1
538 1 27 LYS H 1 28 ILE HB . . 5.110 5.021 4.883 5.112 0.002 9 0 "[ . 1 . 2]" 1
539 1 27 LYS H 1 29 LYS H . . 4.660 4.277 4.010 4.643 . 0 0 "[ . 1 . 2]" 1
540 1 27 LYS HA 1 27 LYS HG2 . . 3.390 2.854 2.765 2.935 . 0 0 "[ . 1 . 2]" 1
541 1 27 LYS HA 1 29 LYS H . . 5.080 4.535 4.042 4.985 . 0 0 "[ . 1 . 2]" 1
542 1 27 LYS HA 1 30 SER H . . 4.050 3.375 3.237 3.581 . 0 0 "[ . 1 . 2]" 1
543 1 27 LYS QB 1 27 LYS HD2 . . 3.690 2.256 2.101 2.498 . 0 0 "[ . 1 . 2]" 1
544 1 27 LYS QB 1 27 LYS QD . . 3.210 2.089 2.028 2.137 . 0 0 "[ . 1 . 2]" 1
545 1 27 LYS QB 1 27 LYS HD3 . . 3.690 2.506 2.321 2.671 . 0 0 "[ . 1 . 2]" 1
546 1 27 LYS QB 1 27 LYS QE . . 4.010 3.562 3.458 3.681 . 0 0 "[ . 1 . 2]" 1
547 1 27 LYS QB 1 28 ILE H . . 3.110 2.260 2.123 2.447 . 0 0 "[ . 1 . 2]" 1
548 1 27 LYS QB 1 30 SER H . . 5.040 4.491 4.413 4.558 . 0 0 "[ . 1 . 2]" 1
549 1 27 LYS QE 1 27 LYS HG2 . . 3.800 2.572 2.220 3.027 . 0 0 "[ . 1 . 2]" 1
550 1 27 LYS QE 1 27 LYS HG3 . . 3.690 2.411 2.161 2.758 . 0 0 "[ . 1 . 2]" 1
551 1 28 ILE H 1 28 ILE HB . . 3.390 2.651 2.524 2.717 . 0 0 "[ . 1 . 2]" 1
552 1 28 ILE H 1 28 ILE MD . . 4.150 3.574 3.464 3.691 . 0 0 "[ . 1 . 2]" 1
553 1 28 ILE H 1 28 ILE HG12 . . 3.630 3.083 2.735 3.315 . 0 0 "[ . 1 . 2]" 1
554 1 28 ILE H 1 28 ILE HG13 . . 3.750 1.956 1.898 2.141 . 0 0 "[ . 1 . 2]" 1
555 1 28 ILE H 1 28 ILE MG . . 3.880 3.762 3.752 3.769 . 0 0 "[ . 1 . 2]" 1
556 1 28 ILE H 1 29 LYS H . . 3.370 2.887 2.694 3.072 . 0 0 "[ . 1 . 2]" 1
557 1 28 ILE H 1 40 VAL MG2 . . 5.500 5.341 5.090 5.502 0.002 9 0 "[ . 1 . 2]" 1
558 1 28 ILE HA 1 28 ILE MD . . 3.930 3.807 3.677 3.860 . 0 0 "[ . 1 . 2]" 1
559 1 28 ILE HA 1 28 ILE HG12 . . 3.740 2.521 2.443 2.595 . 0 0 "[ . 1 . 2]" 1
560 1 28 ILE HA 1 28 ILE HG13 . . 3.630 3.120 2.941 3.343 . 0 0 "[ . 1 . 2]" 1
561 1 28 ILE HA 1 28 ILE MG . . 3.270 2.354 2.247 2.442 . 0 0 "[ . 1 . 2]" 1
562 1 28 ILE HA 1 30 SER H . . 5.040 3.881 3.691 4.003 . 0 0 "[ . 1 . 2]" 1
563 1 28 ILE HA 1 31 THR H . . 4.630 3.340 3.242 3.555 . 0 0 "[ . 1 . 2]" 1
564 1 28 ILE HA 1 31 THR HB . . 4.470 4.109 3.973 4.487 0.017 16 0 "[ . 1 . 2]" 1
565 1 28 ILE HA 1 31 THR MG . . 4.730 3.766 1.869 4.225 . 0 0 "[ . 1 . 2]" 1
566 1 28 ILE HA 1 32 ASN QD . . 3.720 2.691 2.264 3.394 . 0 0 "[ . 1 . 2]" 1
567 1 28 ILE HB 1 28 ILE MD . . 3.180 2.420 2.345 2.578 . 0 0 "[ . 1 . 2]" 1
568 1 28 ILE HB 1 29 LYS H . . 3.350 2.458 2.105 2.869 . 0 0 "[ . 1 . 2]" 1
569 1 28 ILE HB 1 29 LYS HG3 . . 4.270 3.453 3.169 3.751 . 0 0 "[ . 1 . 2]" 1
570 1 28 ILE HB 1 30 SER H . . 5.400 4.612 4.339 4.935 . 0 0 "[ . 1 . 2]" 1
571 1 28 ILE HB 1 32 ASN H . . 5.500 5.490 5.339 5.509 0.009 4 0 "[ . 1 . 2]" 1
572 1 28 ILE HB 1 40 VAL MG2 . . 4.220 3.039 2.688 3.264 . 0 0 "[ . 1 . 2]" 1
573 1 28 ILE MD 1 29 LYS H . . 4.860 4.485 4.188 4.815 . 0 0 "[ . 1 . 2]" 1
574 1 28 ILE MD 1 32 ASN QD . . 5.340 4.501 3.872 4.987 . 0 0 "[ . 1 . 2]" 1
575 1 28 ILE MD 1 40 VAL HA . . 4.090 3.018 2.596 3.214 . 0 0 "[ . 1 . 2]" 1
576 1 28 ILE MD 1 41 ALA HA . . 5.500 5.373 5.134 5.502 0.002 5 0 "[ . 1 . 2]" 1
577 1 28 ILE MD 1 43 LYS HA . . 4.910 4.776 4.634 4.913 0.003 3 0 "[ . 1 . 2]" 1
578 1 28 ILE MD 1 43 LYS HB2 . . 4.120 2.716 2.536 2.845 . 0 0 "[ . 1 . 2]" 1
579 1 28 ILE MD 1 43 LYS HB3 . . 3.960 2.622 2.303 2.884 . 0 0 "[ . 1 . 2]" 1
580 1 28 ILE MD 1 43 LYS QE . . 4.440 3.559 2.134 4.443 0.003 17 0 "[ . 1 . 2]" 1
581 1 28 ILE MD 1 43 LYS HG2 . . 4.680 4.355 3.621 4.678 . 0 0 "[ . 1 . 2]" 1
582 1 28 ILE MD 1 43 LYS HG3 . . 4.680 4.569 4.167 4.681 0.001 5 0 "[ . 1 . 2]" 1
583 1 28 ILE MD 1 44 LEU H . . 4.010 3.218 3.067 3.355 . 0 0 "[ . 1 . 2]" 1
584 1 28 ILE MD 1 44 LEU HA . . 4.040 3.348 3.149 3.660 . 0 0 "[ . 1 . 2]" 1
585 1 28 ILE MD 1 47 MET ME . . 3.160 2.184 1.930 3.005 . 0 0 "[ . 1 . 2]" 1
586 1 28 ILE HG12 1 28 ILE MG . . 3.450 2.400 2.275 2.588 . 0 0 "[ . 1 . 2]" 1
587 1 28 ILE HG13 1 28 ILE MG . . 3.410 3.192 3.170 3.203 . 0 0 "[ . 1 . 2]" 1
588 1 28 ILE HG13 1 44 LEU MD2 . . 4.190 3.745 3.283 3.927 . 0 0 "[ . 1 . 2]" 1
589 1 28 ILE MG 1 29 LYS H . . 3.760 3.407 3.161 3.712 . 0 0 "[ . 1 . 2]" 1
590 1 28 ILE MG 1 29 LYS HA . . 4.010 3.522 3.301 3.828 . 0 0 "[ . 1 . 2]" 1
591 1 28 ILE MG 1 32 ASN H . . 4.680 3.670 3.469 3.795 . 0 0 "[ . 1 . 2]" 1
592 1 28 ILE MG 1 32 ASN QB . . 3.950 2.972 2.601 3.247 . 0 0 "[ . 1 . 2]" 1
593 1 28 ILE MG 1 32 ASN HD21 . . 4.300 2.454 1.825 3.147 . 0 0 "[ . 1 . 2]" 1
594 1 28 ILE MG 1 32 ASN QD . . 3.550 2.291 1.647 2.869 . 0 0 "[ . 1 . 2]" 1
595 1 28 ILE MG 1 32 ASN HD22 . . 4.300 2.832 1.874 3.309 . 0 0 "[ . 1 . 2]" 1
596 1 28 ILE MG 1 35 ILE MD . . 2.970 2.058 1.802 2.465 . 0 0 "[ . 1 . 2]" 1
597 1 28 ILE MG 1 39 ASP QB . . 5.250 4.257 3.967 4.570 . 0 0 "[ . 1 . 2]" 1
598 1 28 ILE MG 1 40 VAL HA . . 3.230 2.518 2.316 2.749 . 0 0 "[ . 1 . 2]" 1
599 1 28 ILE MG 1 43 LYS HB2 . . 4.260 3.321 2.956 3.618 . 0 0 "[ . 1 . 2]" 1
600 1 28 ILE MG 1 43 LYS HB3 . . 4.050 3.779 3.456 4.049 . 0 0 "[ . 1 . 2]" 1
601 1 28 ILE MG 1 43 LYS QD . . 3.650 2.322 1.933 3.301 . 0 0 "[ . 1 . 2]" 1
602 1 28 ILE MG 1 43 LYS QE . . 4.010 2.662 1.956 3.806 . 0 0 "[ . 1 . 2]" 1
603 1 28 ILE MG 1 43 LYS QG . . 4.610 3.996 3.342 4.318 . 0 0 "[ . 1 . 2]" 1
604 1 29 LYS H 1 29 LYS HB2 . . 3.180 2.426 2.321 2.588 . 0 0 "[ . 1 . 2]" 1
605 1 29 LYS H 1 29 LYS HB3 . . 3.630 3.585 3.562 3.609 . 0 0 "[ . 1 . 2]" 1
606 1 29 LYS H 1 29 LYS HD3 . . 4.940 4.452 4.123 4.641 . 0 0 "[ . 1 . 2]" 1
607 1 29 LYS H 1 29 LYS HG2 . . 4.060 3.294 2.916 3.627 . 0 0 "[ . 1 . 2]" 1
608 1 29 LYS H 1 29 LYS HG3 . . 3.350 2.472 2.179 2.705 . 0 0 "[ . 1 . 2]" 1
609 1 29 LYS H 1 30 SER H . . 3.420 2.556 2.420 2.739 . 0 0 "[ . 1 . 2]" 1
610 1 29 LYS H 1 31 THR H . . 5.190 4.042 3.863 4.676 . 0 0 "[ . 1 . 2]" 1
611 1 29 LYS H 1 35 ILE MG . . 4.670 4.077 3.798 4.679 0.009 9 0 "[ . 1 . 2]" 1
612 1 29 LYS H 1 40 VAL MG1 . . 4.800 4.459 4.015 4.792 . 0 0 "[ . 1 . 2]" 1
613 1 29 LYS H 1 40 VAL MG2 . . 4.880 4.051 3.612 4.466 . 0 0 "[ . 1 . 2]" 1
614 1 29 LYS HA 1 29 LYS HD2 . . 5.070 4.782 4.696 4.884 . 0 0 "[ . 1 . 2]" 1
615 1 29 LYS HA 1 29 LYS HD3 . . 4.710 4.461 4.340 4.613 . 0 0 "[ . 1 . 2]" 1
616 1 29 LYS HA 1 29 LYS QE . . 4.940 3.610 3.236 3.899 . 0 0 "[ . 1 . 2]" 1
617 1 29 LYS HA 1 29 LYS HG2 . . 3.360 2.394 2.290 2.544 . 0 0 "[ . 1 . 2]" 1
618 1 29 LYS HA 1 29 LYS HG3 . . 3.680 3.257 3.017 3.441 . 0 0 "[ . 1 . 2]" 1
619 1 29 LYS HA 1 32 ASN H . . 4.040 3.785 3.586 4.064 0.024 16 0 "[ . 1 . 2]" 1
620 1 29 LYS HA 1 32 ASN QB . . 4.350 3.592 3.217 3.844 . 0 0 "[ . 1 . 2]" 1
621 1 29 LYS HA 1 35 ILE MD . . 4.960 4.019 3.397 4.589 . 0 0 "[ . 1 . 2]" 1
622 1 29 LYS HA 1 35 ILE MG . . 3.220 2.159 1.917 2.676 . 0 0 "[ . 1 . 2]" 1
623 1 29 LYS HA 1 40 VAL MG2 . . 4.430 3.770 3.405 3.986 . 0 0 "[ . 1 . 2]" 1
624 1 29 LYS HB2 1 29 LYS HE2 . . 5.240 3.834 3.258 4.545 . 0 0 "[ . 1 . 2]" 1
625 1 29 LYS HB2 1 29 LYS QE . . 4.550 3.616 3.165 4.129 . 0 0 "[ . 1 . 2]" 1
626 1 29 LYS HB2 1 29 LYS HE3 . . 5.240 4.537 3.788 4.891 . 0 0 "[ . 1 . 2]" 1
627 1 29 LYS HB2 1 30 SER H . . 3.660 3.188 3.086 3.318 . 0 0 "[ . 1 . 2]" 1
628 1 29 LYS HB2 1 30 SER HA . . 5.240 4.578 4.454 4.706 . 0 0 "[ . 1 . 2]" 1
629 1 29 LYS HB3 1 29 LYS HD3 . . 3.990 2.527 2.341 2.835 . 0 0 "[ . 1 . 2]" 1
630 1 29 LYS HB3 1 29 LYS HE2 . . 3.960 2.520 2.055 3.397 . 0 0 "[ . 1 . 2]" 1
631 1 29 LYS HB3 1 29 LYS HE3 . . 3.960 3.531 2.349 3.960 . 0 0 "[ . 1 . 2]" 1
632 1 29 LYS HB3 1 30 SER H . . 4.250 4.023 3.909 4.162 . 0 0 "[ . 1 . 2]" 1
633 1 29 LYS HB3 1 30 SER HA . . 4.810 4.553 4.443 4.710 . 0 0 "[ . 1 . 2]" 1
634 1 29 LYS HB3 1 40 VAL MG2 . . 5.150 4.853 4.396 5.151 0.001 9 0 "[ . 1 . 2]" 1
635 1 29 LYS HD2 1 40 VAL MG1 . . 4.590 4.311 3.695 4.568 . 0 0 "[ . 1 . 2]" 1
636 1 29 LYS HD2 1 40 VAL MG2 . . 4.510 3.841 3.329 4.302 . 0 0 "[ . 1 . 2]" 1
637 1 29 LYS HD3 1 35 ILE MG . . 5.290 4.772 4.297 5.290 0.000 9 0 "[ . 1 . 2]" 1
638 1 29 LYS QE 1 35 ILE MG . . 3.980 2.957 2.329 3.424 . 0 0 "[ . 1 . 2]" 1
639 1 29 LYS QE 1 40 VAL MG2 . . 4.590 3.519 2.613 3.977 . 0 0 "[ . 1 . 2]" 1
640 1 29 LYS HE2 1 35 ILE MG . . 4.560 3.443 2.350 4.295 . 0 0 "[ . 1 . 2]" 1
641 1 29 LYS HE3 1 35 ILE MG . . 4.560 3.504 2.680 4.531 . 0 0 "[ . 1 . 2]" 1
642 1 29 LYS HG2 1 35 ILE MG . . 3.610 2.536 2.189 3.006 . 0 0 "[ . 1 . 2]" 1
643 1 29 LYS HG2 1 40 VAL MG2 . . 3.650 2.736 2.279 3.094 . 0 0 "[ . 1 . 2]" 1
644 1 29 LYS HG3 1 30 SER H . . 4.920 4.631 4.437 4.778 . 0 0 "[ . 1 . 2]" 1
645 1 29 LYS HG3 1 40 VAL MG1 . . 4.180 3.656 3.154 3.985 . 0 0 "[ . 1 . 2]" 1
646 1 30 SER H 1 30 SER QB . . 3.120 2.372 2.249 2.947 . 0 0 "[ . 1 . 2]" 1
647 1 30 SER H 1 31 THR H . . 3.490 2.200 2.148 2.450 . 0 0 "[ . 1 . 2]" 1
648 1 30 SER H 1 31 THR HA . . 5.500 4.875 4.846 5.065 . 0 0 "[ . 1 . 2]" 1
649 1 30 SER H 1 31 THR HB . . 5.500 5.528 4.814 5.583 0.083 5 0 "[ . 1 . 2]" 1
650 1 30 SER H 1 31 THR MG . . 4.670 4.402 3.220 4.583 . 0 0 "[ . 1 . 2]" 1
651 1 30 SER H 1 32 ASN H . . 4.700 3.869 3.654 3.973 . 0 0 "[ . 1 . 2]" 1
652 1 30 SER HA 1 30 SER QB . . 2.720 2.391 2.175 2.482 . 0 0 "[ . 1 . 2]" 1
653 1 30 SER HA 1 31 THR MG . . 5.390 5.144 4.741 5.271 . 0 0 "[ . 1 . 2]" 1
654 1 30 SER HA 1 32 ASN H . . 4.760 4.702 4.518 4.772 0.012 15 0 "[ . 1 . 2]" 1
655 1 30 SER QB 1 31 THR H . . 4.000 3.044 2.257 3.486 . 0 0 "[ . 1 . 2]" 1
656 1 30 SER QB 1 31 THR HA . . 4.520 4.189 3.835 4.512 . 0 0 "[ . 1 . 2]" 1
657 1 30 SER QB 1 31 THR MG . . 4.020 3.691 3.306 4.034 0.014 15 0 "[ . 1 . 2]" 1
658 1 31 THR H 1 31 THR HB . . 4.020 3.433 2.510 3.556 . 0 0 "[ . 1 . 2]" 1
659 1 31 THR H 1 31 THR MG . . 3.790 3.065 1.805 3.346 . 0 0 "[ . 1 . 2]" 1
660 1 31 THR H 1 32 ASN H . . 3.290 2.283 2.034 2.707 . 0 0 "[ . 1 . 2]" 1
661 1 31 THR HA 1 31 THR MG . . 3.110 2.263 2.042 3.197 0.087 15 0 "[ . 1 . 2]" 1
662 1 31 THR HA 1 32 ASN HA . . 4.820 4.620 4.576 4.667 . 0 0 "[ . 1 . 2]" 1
663 1 31 THR HB 1 32 ASN H . . 4.330 3.326 3.199 4.083 . 0 0 "[ . 1 . 2]" 1
664 1 31 THR HB 1 32 ASN HA . . 5.500 4.265 4.080 5.598 0.098 15 0 "[ . 1 . 2]" 1
665 1 31 THR HB 1 32 ASN HD21 . . 5.290 3.326 2.476 5.105 . 0 0 "[ . 1 . 2]" 1
666 1 31 THR HB 1 32 ASN QD . . 4.640 3.056 2.370 4.627 . 0 0 "[ . 1 . 2]" 1
667 1 31 THR HB 1 32 ASN HD22 . . 5.290 3.600 3.023 5.294 0.004 16 0 "[ . 1 . 2]" 1
668 1 31 THR MG 1 32 ASN H . . 4.620 3.924 1.842 4.234 . 0 0 "[ . 1 . 2]" 1
669 1 31 THR MG 1 32 ASN QD . . 4.860 3.789 1.869 4.768 . 0 0 "[ . 1 . 2]" 1
670 1 32 ASN H 1 32 ASN HB2 . . 3.970 2.444 2.282 2.571 . 0 0 "[ . 1 . 2]" 1
671 1 32 ASN H 1 32 ASN QB . . 3.340 2.408 2.256 2.525 . 0 0 "[ . 1 . 2]" 1
672 1 32 ASN H 1 32 ASN HB3 . . 3.970 3.637 3.556 3.685 . 0 0 "[ . 1 . 2]" 1
673 1 32 ASN H 1 32 ASN QD . . 4.110 2.095 1.796 3.033 . 0 0 "[ . 1 . 2]" 1
674 1 32 ASN H 1 33 PRO HD2 . . 4.800 4.796 4.463 4.839 0.039 1 0 "[ . 1 . 2]" 1
675 1 32 ASN H 1 33 PRO HD3 . . 4.800 4.726 3.953 4.845 0.045 2 0 "[ . 1 . 2]" 1
676 1 32 ASN H 1 35 ILE HB . . 5.260 4.430 3.990 4.904 . 0 0 "[ . 1 . 2]" 1
677 1 32 ASN H 1 35 ILE MG . . 4.900 3.987 3.269 4.368 . 0 0 "[ . 1 . 2]" 1
678 1 32 ASN HA 1 33 PRO HD2 . . 3.250 2.073 1.919 2.126 . 0 0 "[ . 1 . 2]" 1
679 1 32 ASN HA 1 33 PRO QD . . 2.820 1.923 1.868 1.946 . 0 0 "[ . 1 . 2]" 1
680 1 32 ASN HA 1 33 PRO HD3 . . 3.250 2.299 2.256 2.624 . 0 0 "[ . 1 . 2]" 1
681 1 32 ASN HA 1 33 PRO HG2 . . 5.000 4.250 4.115 4.294 . 0 0 "[ . 1 . 2]" 1
682 1 32 ASN HA 1 33 PRO HG3 . . 5.000 4.341 4.317 4.453 . 0 0 "[ . 1 . 2]" 1
683 1 32 ASN HA 1 35 ILE HB . . 5.360 4.381 4.247 4.567 . 0 0 "[ . 1 . 2]" 1
684 1 32 ASN HA 1 35 ILE MG . . 5.500 4.998 4.384 5.374 . 0 0 "[ . 1 . 2]" 1
685 1 32 ASN QB 1 35 ILE H . . 3.920 3.601 3.248 3.923 0.003 9 0 "[ . 1 . 2]" 1
686 1 32 ASN QB 1 35 ILE HA . . 4.220 3.692 3.205 4.118 . 0 0 "[ . 1 . 2]" 1
687 1 32 ASN QB 1 35 ILE HB . . 3.240 1.931 1.842 2.116 . 0 0 "[ . 1 . 2]" 1
688 1 32 ASN QB 1 35 ILE QG . . 4.340 3.343 2.977 3.686 . 0 0 "[ . 1 . 2]" 1
689 1 32 ASN QB 1 35 ILE MG . . 3.280 2.566 1.961 3.049 . 0 0 "[ . 1 . 2]" 1
690 1 32 ASN HB2 1 35 ILE H . . 4.670 4.022 3.627 4.610 . 0 0 "[ . 1 . 2]" 1
691 1 32 ASN HB2 1 35 ILE HB . . 3.820 2.173 1.997 2.700 . 0 0 "[ . 1 . 2]" 1
692 1 32 ASN HB2 1 35 ILE MD . . 3.780 2.332 1.980 2.770 . 0 0 "[ . 1 . 2]" 1
693 1 32 ASN HB2 1 35 ILE MG . . 3.800 2.635 1.978 3.212 . 0 0 "[ . 1 . 2]" 1
694 1 32 ASN HB3 1 35 ILE H . . 4.670 4.086 3.536 4.404 . 0 0 "[ . 1 . 2]" 1
695 1 32 ASN HB3 1 35 ILE HB . . 3.820 2.205 1.998 2.341 . 0 0 "[ . 1 . 2]" 1
696 1 32 ASN HB3 1 35 ILE MD . . 3.780 2.743 2.261 3.467 . 0 0 "[ . 1 . 2]" 1
697 1 32 ASN HB3 1 35 ILE MG . . 3.800 3.594 2.973 3.802 0.002 1 0 "[ . 1 . 2]" 1
698 1 32 ASN QD 1 35 ILE MD . . 4.380 3.040 2.147 3.498 . 0 0 "[ . 1 . 2]" 1
699 1 32 ASN QD 1 35 ILE MG . . 4.900 3.999 3.352 4.560 . 0 0 "[ . 1 . 2]" 1
700 1 33 PRO HA 1 35 ILE H . . 4.680 4.185 3.733 4.685 0.005 20 0 "[ . 1 . 2]" 1
701 1 35 ILE H 1 35 ILE HB . . 3.050 2.600 2.367 2.985 . 0 0 "[ . 1 . 2]" 1
702 1 35 ILE H 1 35 ILE HG12 . . 4.680 4.518 4.382 4.644 . 0 0 "[ . 1 . 2]" 1
703 1 35 ILE H 1 35 ILE QG . . 4.120 3.982 3.951 4.031 . 0 0 "[ . 1 . 2]" 1
704 1 35 ILE H 1 35 ILE HG13 . . 4.680 4.430 4.277 4.598 . 0 0 "[ . 1 . 2]" 1
705 1 35 ILE H 1 35 ILE MG . . 2.890 2.104 1.877 2.429 . 0 0 "[ . 1 . 2]" 1
706 1 35 ILE H 1 36 SER H . . 4.680 4.582 4.400 4.638 . 0 0 "[ . 1 . 2]" 1
707 1 35 ILE H 1 40 VAL MG2 . . 5.460 5.008 4.590 5.441 . 0 0 "[ . 1 . 2]" 1
708 1 35 ILE HA 1 35 ILE MD . . 4.000 3.644 3.542 3.759 . 0 0 "[ . 1 . 2]" 1
709 1 35 ILE HA 1 35 ILE HG12 . . 3.480 3.232 3.125 3.314 . 0 0 "[ . 1 . 2]" 1
710 1 35 ILE HA 1 35 ILE QG . . 2.960 2.281 2.195 2.415 . 0 0 "[ . 1 . 2]" 1
711 1 35 ILE HA 1 35 ILE HG13 . . 3.480 2.333 2.233 2.487 . 0 0 "[ . 1 . 2]" 1
712 1 35 ILE HA 1 35 ILE MG . . 3.510 3.194 3.183 3.201 . 0 0 "[ . 1 . 2]" 1
713 1 35 ILE HA 1 36 SER H . . 2.810 2.231 2.140 2.398 . 0 0 "[ . 1 . 2]" 1
714 1 35 ILE HA 1 39 ASP QB . . 4.660 3.866 3.639 4.098 . 0 0 "[ . 1 . 2]" 1
715 1 35 ILE HA 1 40 VAL MG2 . . 5.000 4.721 4.528 4.992 . 0 0 "[ . 1 . 2]" 1
716 1 35 ILE HB 1 35 ILE MD . . 3.250 2.300 2.192 2.410 . 0 0 "[ . 1 . 2]" 1
717 1 35 ILE HB 1 36 SER H . . 4.260 4.059 3.801 4.262 0.002 19 0 "[ . 1 . 2]" 1
718 1 35 ILE HB 1 39 ASP HB2 . . 5.020 4.724 4.527 5.030 0.010 19 0 "[ . 1 . 2]" 1
719 1 35 ILE HB 1 39 ASP QB . . 4.290 4.179 4.057 4.291 0.001 12 0 "[ . 1 . 2]" 1
720 1 35 ILE HB 1 39 ASP HB3 . . 5.020 4.708 4.283 5.021 0.001 17 0 "[ . 1 . 2]" 1
721 1 35 ILE HB 1 40 VAL MG2 . . 4.350 3.879 3.561 4.353 0.003 19 0 "[ . 1 . 2]" 1
722 1 35 ILE MD 1 35 ILE MG . . 2.880 2.207 1.937 2.381 . 0 0 "[ . 1 . 2]" 1
723 1 35 ILE MD 1 36 SER H . . 4.500 3.970 3.483 4.506 0.006 19 0 "[ . 1 . 2]" 1
724 1 35 ILE MD 1 39 ASP HB2 . . 3.780 2.843 2.378 3.396 . 0 0 "[ . 1 . 2]" 1
725 1 35 ILE MD 1 39 ASP QB . . 3.060 2.013 1.871 2.241 . 0 0 "[ . 1 . 2]" 1
726 1 35 ILE MD 1 39 ASP HB3 . . 3.780 2.071 1.912 2.340 . 0 0 "[ . 1 . 2]" 1
727 1 35 ILE MD 1 40 VAL H . . 4.230 2.659 2.135 3.053 . 0 0 "[ . 1 . 2]" 1
728 1 35 ILE MD 1 40 VAL HA . . 3.400 2.643 2.307 2.830 . 0 0 "[ . 1 . 2]" 1
729 1 35 ILE MD 1 40 VAL MG2 . . 2.990 1.974 1.827 2.270 . 0 0 "[ . 1 . 2]" 1
730 1 35 ILE MD 1 43 LYS HB2 . . 4.940 4.163 3.853 4.327 . 0 0 "[ . 1 . 2]" 1
731 1 35 ILE MD 1 43 LYS HB3 . . 5.310 5.188 4.900 5.307 . 0 0 "[ . 1 . 2]" 1
732 1 35 ILE MD 1 43 LYS HD2 . . 4.370 3.251 2.525 4.362 . 0 0 "[ . 1 . 2]" 1
733 1 35 ILE MD 1 43 LYS HD3 . . 4.370 3.503 2.608 4.342 . 0 0 "[ . 1 . 2]" 1
734 1 35 ILE MD 1 43 LYS QE . . 3.670 3.047 2.185 3.669 . 0 0 "[ . 1 . 2]" 1
735 1 35 ILE MD 1 43 LYS QG . . 4.500 4.083 3.574 4.467 . 0 0 "[ . 1 . 2]" 1
736 1 35 ILE QG 1 35 ILE MG . . 2.940 2.171 2.089 2.289 . 0 0 "[ . 1 . 2]" 1
737 1 35 ILE QG 1 40 VAL H . . 3.750 2.556 2.290 2.774 . 0 0 "[ . 1 . 2]" 1
738 1 35 ILE QG 1 40 VAL MG2 . . 2.930 2.027 1.942 2.172 . 0 0 "[ . 1 . 2]" 1
739 1 35 ILE HG12 1 35 ILE MG . . 3.400 2.211 2.119 2.346 . 0 0 "[ . 1 . 2]" 1
740 1 35 ILE HG12 1 36 SER H . . 3.770 2.790 2.080 3.385 . 0 0 "[ . 1 . 2]" 1
741 1 35 ILE HG12 1 39 ASP HB2 . . 3.980 2.488 2.023 3.474 . 0 0 "[ . 1 . 2]" 1
742 1 35 ILE HG12 1 39 ASP HB3 . . 3.980 2.944 2.417 3.467 . 0 0 "[ . 1 . 2]" 1
743 1 35 ILE HG12 1 40 VAL H . . 4.480 2.607 2.321 2.850 . 0 0 "[ . 1 . 2]" 1
744 1 35 ILE HG12 1 40 VAL MG2 . . 3.520 2.041 1.954 2.194 . 0 0 "[ . 1 . 2]" 1
745 1 35 ILE HG13 1 35 ILE MG . . 3.400 3.172 3.155 3.196 . 0 0 "[ . 1 . 2]" 1
746 1 35 ILE HG13 1 36 SER H . . 3.770 2.418 1.998 3.049 . 0 0 "[ . 1 . 2]" 1
747 1 35 ILE HG13 1 39 ASP HB2 . . 3.980 2.276 2.103 2.556 . 0 0 "[ . 1 . 2]" 1
748 1 35 ILE HG13 1 39 ASP HB3 . . 3.980 2.493 1.997 2.924 . 0 0 "[ . 1 . 2]" 1
749 1 35 ILE HG13 1 40 VAL H . . 4.480 3.738 3.425 4.076 . 0 0 "[ . 1 . 2]" 1
750 1 35 ILE HG13 1 40 VAL MG2 . . 3.520 3.461 3.343 3.522 0.002 20 0 "[ . 1 . 2]" 1
751 1 35 ILE MG 1 36 SER H . . 4.310 3.732 3.357 4.120 . 0 0 "[ . 1 . 2]" 1
752 1 35 ILE MG 1 39 ASP HB2 . . 5.120 4.305 3.935 5.122 0.002 13 0 "[ . 1 . 2]" 1
753 1 35 ILE MG 1 39 ASP HB3 . . 5.120 4.550 4.165 4.923 . 0 0 "[ . 1 . 2]" 1
754 1 35 ILE MG 1 40 VAL H . . 5.010 3.902 3.453 4.296 . 0 0 "[ . 1 . 2]" 1
755 1 35 ILE MG 1 40 VAL HA . . 4.900 4.481 4.017 4.904 0.004 20 0 "[ . 1 . 2]" 1
756 1 36 SER H 1 36 SER HB2 . . 3.900 2.744 2.327 3.693 . 0 0 "[ . 1 . 2]" 1
757 1 36 SER H 1 36 SER QB . . 3.330 2.387 2.226 2.871 . 0 0 "[ . 1 . 2]" 1
758 1 36 SER H 1 36 SER HB3 . . 3.900 2.981 2.294 3.689 . 0 0 "[ . 1 . 2]" 1
759 1 36 SER H 1 39 ASP H . . 4.700 3.821 3.405 4.027 . 0 0 "[ . 1 . 2]" 1
760 1 36 SER H 1 39 ASP HB2 . . 4.400 2.805 2.422 3.574 . 0 0 "[ . 1 . 2]" 1
761 1 36 SER H 1 39 ASP QB . . 3.620 2.745 2.401 3.394 . 0 0 "[ . 1 . 2]" 1
762 1 36 SER H 1 39 ASP HB3 . . 4.400 4.052 3.686 4.303 . 0 0 "[ . 1 . 2]" 1
763 1 36 SER H 1 40 VAL MG2 . . 4.870 4.334 3.773 4.850 . 0 0 "[ . 1 . 2]" 1
764 1 36 SER HA 1 37 ILE H . . 3.110 2.247 2.197 2.304 . 0 0 "[ . 1 . 2]" 1
765 1 36 SER HA 1 37 ILE HA . . 4.550 4.304 4.297 4.315 . 0 0 "[ . 1 . 2]" 1
766 1 36 SER HA 1 37 ILE HB . . 4.870 4.810 4.668 4.870 0.000 7 0 "[ . 1 . 2]" 1
767 1 36 SER QB 1 37 ILE H . . 3.470 3.143 2.765 3.457 . 0 0 "[ . 1 . 2]" 1
768 1 36 SER HB2 1 37 ILE H . . 4.230 3.845 2.814 4.216 . 0 0 "[ . 1 . 2]" 1
769 1 36 SER HB3 1 37 ILE H . . 4.230 3.547 2.823 4.178 . 0 0 "[ . 1 . 2]" 1
770 1 37 ILE H 1 37 ILE HB . . 3.370 2.642 2.536 2.782 . 0 0 "[ . 1 . 2]" 1
771 1 37 ILE H 1 37 ILE HG12 . . 3.880 3.188 1.933 3.801 . 0 0 "[ . 1 . 2]" 1
772 1 37 ILE H 1 37 ILE QG . . 3.350 2.124 1.889 2.849 . 0 0 "[ . 1 . 2]" 1
773 1 37 ILE H 1 37 ILE HG13 . . 3.880 2.450 1.898 3.597 . 0 0 "[ . 1 . 2]" 1
774 1 37 ILE H 1 37 ILE MG . . 3.920 3.775 3.764 3.787 . 0 0 "[ . 1 . 2]" 1
775 1 37 ILE HA 1 37 ILE MD . . 3.880 3.387 1.933 3.880 . 0 0 "[ . 1 . 2]" 1
776 1 37 ILE HA 1 37 ILE HG12 . . 4.000 2.897 2.425 3.523 . 0 0 "[ . 1 . 2]" 1
777 1 37 ILE HA 1 37 ILE QG . . 3.420 2.487 2.246 3.093 . 0 0 "[ . 1 . 2]" 1
778 1 37 ILE HA 1 37 ILE HG13 . . 4.000 2.893 2.274 3.731 . 0 0 "[ . 1 . 2]" 1
779 1 37 ILE HA 1 37 ILE MG . . 3.160 2.394 2.314 2.463 . 0 0 "[ . 1 . 2]" 1
780 1 37 ILE HA 1 39 ASP H . . 5.100 4.494 4.201 4.843 . 0 0 "[ . 1 . 2]" 1
781 1 37 ILE HA 1 40 VAL H . . 3.910 3.759 3.489 3.910 0.000 9 0 "[ . 1 . 2]" 1
782 1 37 ILE HA 1 40 VAL HB . . 3.490 2.955 2.637 3.257 . 0 0 "[ . 1 . 2]" 1
783 1 37 ILE HA 1 40 VAL MG2 . . 3.530 3.133 2.635 3.498 . 0 0 "[ . 1 . 2]" 1
784 1 37 ILE HA 1 41 ALA H . . 4.760 4.024 3.667 4.482 . 0 0 "[ . 1 . 2]" 1
785 1 37 ILE HB 1 37 ILE MD . . 3.450 2.436 2.089 3.228 . 0 0 "[ . 1 . 2]" 1
786 1 37 ILE HB 1 38 GLY H . . 4.340 2.566 2.258 2.820 . 0 0 "[ . 1 . 2]" 1
787 1 37 ILE QG 1 37 ILE MG . . 3.150 2.163 1.962 2.369 . 0 0 "[ . 1 . 2]" 1
788 1 37 ILE QG 1 38 GLY H . . 4.730 4.101 3.832 4.379 . 0 0 "[ . 1 . 2]" 1
789 1 37 ILE HG12 1 37 ILE MG . . 3.650 2.380 2.018 3.199 . 0 0 "[ . 1 . 2]" 1
790 1 37 ILE HG13 1 37 ILE MG . . 3.650 2.906 2.257 3.191 . 0 0 "[ . 1 . 2]" 1
791 1 37 ILE MG 1 38 GLY H . . 4.270 3.385 2.816 3.621 . 0 0 "[ . 1 . 2]" 1
792 1 37 ILE MG 1 38 GLY QA . . 4.130 3.377 3.012 3.539 . 0 0 "[ . 1 . 2]" 1
793 1 37 ILE MG 1 41 ALA H . . 4.110 3.655 3.387 4.064 . 0 0 "[ . 1 . 2]" 1
794 1 37 ILE MG 1 41 ALA MB . . 3.780 3.068 2.662 3.501 . 0 0 "[ . 1 . 2]" 1
795 1 38 GLY H 1 39 ASP H . . 4.180 2.891 2.683 3.128 . 0 0 "[ . 1 . 2]" 1
796 1 38 GLY QA 1 39 ASP HA . . 4.690 4.019 4.000 4.031 . 0 0 "[ . 1 . 2]" 1
797 1 38 GLY QA 1 40 VAL H . . 4.950 4.484 4.200 4.783 . 0 0 "[ . 1 . 2]" 1
798 1 38 GLY QA 1 41 ALA H . . 4.190 3.735 3.460 4.057 . 0 0 "[ . 1 . 2]" 1
799 1 38 GLY QA 1 41 ALA MB . . 3.560 2.771 2.373 3.217 . 0 0 "[ . 1 . 2]" 1
800 1 38 GLY QA 1 42 LYS H . . 4.760 4.199 3.788 4.650 . 0 0 "[ . 1 . 2]" 1
801 1 39 ASP H 1 39 ASP HB2 . . 3.830 2.276 2.183 2.457 . 0 0 "[ . 1 . 2]" 1
802 1 39 ASP H 1 39 ASP QB . . 3.180 2.241 2.133 2.418 . 0 0 "[ . 1 . 2]" 1
803 1 39 ASP H 1 39 ASP HB3 . . 3.830 3.418 2.890 3.595 . 0 0 "[ . 1 . 2]" 1
804 1 39 ASP H 1 40 VAL H . . 3.410 2.887 2.616 3.082 . 0 0 "[ . 1 . 2]" 1
805 1 39 ASP H 1 40 VAL MG2 . . 4.810 4.324 4.071 4.530 . 0 0 "[ . 1 . 2]" 1
806 1 39 ASP HA 1 41 ALA H . . 4.740 4.515 4.274 4.700 . 0 0 "[ . 1 . 2]" 1
807 1 39 ASP HA 1 41 ALA MB . . 5.500 4.830 4.652 5.068 . 0 0 "[ . 1 . 2]" 1
808 1 39 ASP HA 1 42 LYS H . . 3.820 3.587 3.364 3.751 . 0 0 "[ . 1 . 2]" 1
809 1 39 ASP HA 1 42 LYS QB . . 3.070 2.962 2.683 3.074 0.004 18 0 "[ . 1 . 2]" 1
810 1 39 ASP HA 1 42 LYS QD . . 4.260 3.932 3.531 4.263 0.003 12 0 "[ . 1 . 2]" 1
811 1 39 ASP HA 1 42 LYS QG . . 5.190 4.914 4.509 5.100 . 0 0 "[ . 1 . 2]" 1
812 1 39 ASP HA 1 43 LYS H . . 4.530 4.335 3.989 4.495 . 0 0 "[ . 1 . 2]" 1
813 1 39 ASP HA 1 43 LYS QG . . 5.340 4.877 4.274 5.322 . 0 0 "[ . 1 . 2]" 1
814 1 39 ASP QB 1 40 VAL H . . 3.510 2.286 1.936 2.622 . 0 0 "[ . 1 . 2]" 1
815 1 39 ASP QB 1 40 VAL HA . . 4.760 3.752 3.700 3.824 . 0 0 "[ . 1 . 2]" 1
816 1 39 ASP QB 1 40 VAL MG2 . . 4.050 3.125 2.988 3.348 . 0 0 "[ . 1 . 2]" 1
817 1 39 ASP QB 1 42 LYS QB . . 4.910 4.449 4.195 4.662 . 0 0 "[ . 1 . 2]" 1
818 1 39 ASP HB2 1 40 VAL H . . 4.140 2.610 2.255 3.405 . 0 0 "[ . 1 . 2]" 1
819 1 39 ASP HB2 1 40 VAL HA . . 5.500 4.701 4.385 5.410 . 0 0 "[ . 1 . 2]" 1
820 1 39 ASP HB2 1 40 VAL MG2 . . 4.790 3.590 3.160 4.424 . 0 0 "[ . 1 . 2]" 1
821 1 39 ASP HB3 1 40 VAL H . . 4.140 2.849 1.951 3.244 . 0 0 "[ . 1 . 2]" 1
822 1 39 ASP HB3 1 40 VAL HA . . 5.500 3.978 3.781 4.132 . 0 0 "[ . 1 . 2]" 1
823 1 39 ASP HB3 1 40 VAL MG2 . . 4.790 3.622 3.045 3.880 . 0 0 "[ . 1 . 2]" 1
824 1 40 VAL H 1 40 VAL HB . . 3.070 2.603 2.495 2.717 . 0 0 "[ . 1 . 2]" 1
825 1 40 VAL H 1 40 VAL MG1 . . 3.780 3.769 3.758 3.786 0.006 5 0 "[ . 1 . 2]" 1
826 1 40 VAL H 1 40 VAL MG2 . . 3.090 2.046 1.877 2.267 . 0 0 "[ . 1 . 2]" 1
827 1 40 VAL H 1 41 ALA H . . 3.210 2.926 2.685 3.209 . 0 0 "[ . 1 . 2]" 1
828 1 40 VAL H 1 41 ALA MB . . 4.680 4.467 4.302 4.683 0.003 20 0 "[ . 1 . 2]" 1
829 1 40 VAL H 1 42 LYS H . . 4.550 4.445 4.246 4.551 0.001 13 0 "[ . 1 . 2]" 1
830 1 40 VAL HA 1 40 VAL MG1 . . 3.040 2.407 2.291 2.484 . 0 0 "[ . 1 . 2]" 1
831 1 40 VAL HA 1 40 VAL MG2 . . 3.070 2.365 2.225 2.446 . 0 0 "[ . 1 . 2]" 1
832 1 40 VAL HA 1 42 LYS H . . 5.140 4.521 4.249 4.620 . 0 0 "[ . 1 . 2]" 1
833 1 40 VAL HA 1 43 LYS H . . 4.030 3.602 3.429 3.889 . 0 0 "[ . 1 . 2]" 1
834 1 40 VAL HA 1 43 LYS HB2 . . 3.730 2.743 2.641 2.871 . 0 0 "[ . 1 . 2]" 1
835 1 40 VAL HA 1 43 LYS HB3 . . 4.340 4.301 4.215 4.343 0.003 12 0 "[ . 1 . 2]" 1
836 1 40 VAL HA 1 43 LYS QD . . 4.740 3.087 2.589 4.202 . 0 0 "[ . 1 . 2]" 1
837 1 40 VAL HA 1 43 LYS QE . . 5.500 4.168 2.527 5.108 . 0 0 "[ . 1 . 2]" 1
838 1 40 VAL HA 1 43 LYS QG . . 4.980 4.141 3.650 4.526 . 0 0 "[ . 1 . 2]" 1
839 1 40 VAL HA 1 44 LEU H . . 4.640 3.812 3.591 3.925 . 0 0 "[ . 1 . 2]" 1
840 1 40 VAL HA 1 44 LEU MD1 . . 5.110 4.391 3.948 4.874 . 0 0 "[ . 1 . 2]" 1
841 1 40 VAL HB 1 41 ALA H . . 3.290 2.479 2.212 2.727 . 0 0 "[ . 1 . 2]" 1
842 1 40 VAL HB 1 41 ALA MB . . 4.280 3.970 3.826 4.125 . 0 0 "[ . 1 . 2]" 1
843 1 40 VAL MG1 1 41 ALA H . . 3.780 3.316 3.030 3.567 . 0 0 "[ . 1 . 2]" 1
844 1 40 VAL MG1 1 41 ALA HA . . 3.950 3.428 3.292 3.561 . 0 0 "[ . 1 . 2]" 1
845 1 40 VAL MG1 1 41 ALA MB . . 4.660 4.108 3.959 4.267 . 0 0 "[ . 1 . 2]" 1
846 1 40 VAL MG1 1 42 LYS H . . 5.370 4.987 4.817 5.080 . 0 0 "[ . 1 . 2]" 1
847 1 40 VAL MG1 1 43 LYS HB2 . . 4.780 3.797 3.505 4.134 . 0 0 "[ . 1 . 2]" 1
848 1 40 VAL MG1 1 44 LEU H . . 4.250 3.465 3.258 3.678 . 0 0 "[ . 1 . 2]" 1
849 1 40 VAL MG1 1 44 LEU HB3 . . 5.020 4.563 4.323 4.770 . 0 0 "[ . 1 . 2]" 1
850 1 40 VAL MG1 1 44 LEU MD1 . . 2.920 1.996 1.793 2.230 . 0 0 "[ . 1 . 2]" 1
851 1 40 VAL MG1 1 44 LEU HG . . 3.460 2.169 1.973 2.394 . 0 0 "[ . 1 . 2]" 1
852 1 40 VAL MG2 1 41 ALA H . . 4.210 3.809 3.696 3.943 . 0 0 "[ . 1 . 2]" 1
853 1 41 ALA H 1 41 ALA MB . . 2.770 2.103 2.027 2.236 . 0 0 "[ . 1 . 2]" 1
854 1 41 ALA H 1 42 LYS H . . 3.190 2.856 2.638 2.971 . 0 0 "[ . 1 . 2]" 1
855 1 41 ALA HA 1 44 LEU H . . 4.040 3.874 3.724 4.030 . 0 0 "[ . 1 . 2]" 1
856 1 41 ALA HA 1 44 LEU HB2 . . 3.700 2.807 2.636 2.984 . 0 0 "[ . 1 . 2]" 1
857 1 41 ALA HA 1 44 LEU HB3 . . 4.560 4.341 4.138 4.541 . 0 0 "[ . 1 . 2]" 1
858 1 41 ALA HA 1 44 LEU MD1 . . 3.530 2.443 1.983 2.958 . 0 0 "[ . 1 . 2]" 1
859 1 41 ALA HA 1 44 LEU MD2 . . 5.500 4.816 4.663 5.037 . 0 0 "[ . 1 . 2]" 1
860 1 41 ALA HA 1 44 LEU HG . . 4.150 3.772 3.460 4.038 . 0 0 "[ . 1 . 2]" 1
861 1 41 ALA HA 1 45 GLY H . . 4.430 4.084 3.811 4.359 . 0 0 "[ . 1 . 2]" 1
862 1 41 ALA MB 1 42 LYS H . . 3.000 2.500 2.334 2.764 . 0 0 "[ . 1 . 2]" 1
863 1 41 ALA MB 1 42 LYS QB . . 3.960 3.802 3.705 3.913 . 0 0 "[ . 1 . 2]" 1
864 1 41 ALA MB 1 44 LEU H . . 5.170 4.946 4.841 5.101 . 0 0 "[ . 1 . 2]" 1
865 1 41 ALA MB 1 44 LEU HB2 . . 4.460 4.254 4.134 4.364 . 0 0 "[ . 1 . 2]" 1
866 1 41 ALA MB 1 44 LEU MD1 . . 4.080 3.667 3.408 4.020 . 0 0 "[ . 1 . 2]" 1
867 1 42 LYS H 1 42 LYS QB . . 2.770 2.216 2.130 2.246 . 0 0 "[ . 1 . 2]" 1
868 1 42 LYS H 1 42 LYS QD . . 4.630 4.387 3.723 4.630 . 0 0 "[ . 1 . 2]" 1
869 1 42 LYS H 1 42 LYS HG2 . . 4.730 4.488 4.362 4.631 . 0 0 "[ . 1 . 2]" 1
870 1 42 LYS H 1 42 LYS HG3 . . 4.730 4.405 4.193 4.510 . 0 0 "[ . 1 . 2]" 1
871 1 42 LYS H 1 43 LYS H . . 3.250 2.829 2.602 2.981 . 0 0 "[ . 1 . 2]" 1
872 1 42 LYS H 1 44 LEU H . . 4.760 4.493 4.362 4.672 . 0 0 "[ . 1 . 2]" 1
873 1 42 LYS HA 1 42 LYS QD . . 4.220 3.926 2.502 4.224 0.004 7 0 "[ . 1 . 2]" 1
874 1 42 LYS HA 1 42 LYS HG2 . . 3.840 3.163 2.709 3.630 . 0 0 "[ . 1 . 2]" 1
875 1 42 LYS HA 1 42 LYS QG . . 3.230 2.433 2.207 2.567 . 0 0 "[ . 1 . 2]" 1
876 1 42 LYS HA 1 42 LYS HG3 . . 3.840 2.551 2.257 2.781 . 0 0 "[ . 1 . 2]" 1
877 1 42 LYS HA 1 45 GLY H . . 4.290 4.057 3.810 4.259 . 0 0 "[ . 1 . 2]" 1
878 1 42 LYS QB 1 42 LYS QD . . 3.230 2.162 2.093 2.277 . 0 0 "[ . 1 . 2]" 1
879 1 42 LYS QB 1 42 LYS QE . . 4.480 2.931 2.008 3.750 . 0 0 "[ . 1 . 2]" 1
880 1 42 LYS QB 1 43 LYS H . . 3.220 2.355 2.134 2.659 . 0 0 "[ . 1 . 2]" 1
881 1 42 LYS QG 1 43 LYS H . . 4.610 3.518 3.059 3.986 . 0 0 "[ . 1 . 2]" 1
882 1 42 LYS QG 1 46 GLU QG . . 4.330 3.802 3.506 4.333 0.003 12 0 "[ . 1 . 2]" 1
883 1 43 LYS H 1 43 LYS HB2 . . 3.390 2.276 2.202 2.493 . 0 0 "[ . 1 . 2]" 1
884 1 43 LYS H 1 43 LYS HB3 . . 3.690 3.537 3.504 3.593 . 0 0 "[ . 1 . 2]" 1
885 1 43 LYS H 1 43 LYS QE . . 5.030 4.556 3.169 5.029 . 0 0 "[ . 1 . 2]" 1
886 1 43 LYS H 1 43 LYS HG2 . . 4.210 3.881 3.508 4.119 . 0 0 "[ . 1 . 2]" 1
887 1 43 LYS H 1 43 LYS QG . . 3.400 2.651 2.173 3.308 . 0 0 "[ . 1 . 2]" 1
888 1 43 LYS H 1 43 LYS HG3 . . 4.210 2.703 2.195 3.485 . 0 0 "[ . 1 . 2]" 1
889 1 43 LYS H 1 44 LEU H . . 3.240 2.893 2.771 3.005 . 0 0 "[ . 1 . 2]" 1
890 1 43 LYS HA 1 43 LYS QD . . 4.410 3.994 3.197 4.158 . 0 0 "[ . 1 . 2]" 1
891 1 43 LYS HA 1 43 LYS HG2 . . 3.700 2.581 2.286 3.482 . 0 0 "[ . 1 . 2]" 1
892 1 43 LYS HA 1 43 LYS HG3 . . 3.700 2.707 2.206 3.010 . 0 0 "[ . 1 . 2]" 1
893 1 43 LYS HA 1 46 GLU H . . 3.810 3.608 3.393 3.787 . 0 0 "[ . 1 . 2]" 1
894 1 43 LYS HA 1 46 GLU HB2 . . 3.510 2.885 2.788 2.964 . 0 0 "[ . 1 . 2]" 1
895 1 43 LYS HA 1 46 GLU HB3 . . 4.490 4.441 4.359 4.500 0.010 17 0 "[ . 1 . 2]" 1
896 1 43 LYS HA 1 46 GLU HG2 . . 5.020 4.728 3.821 5.023 0.003 5 0 "[ . 1 . 2]" 1
897 1 43 LYS HA 1 46 GLU QG . . 4.220 3.749 3.390 3.931 . 0 0 "[ . 1 . 2]" 1
898 1 43 LYS HA 1 46 GLU HG3 . . 5.020 3.987 3.447 5.002 . 0 0 "[ . 1 . 2]" 1
899 1 43 LYS HA 1 47 MET H . . 4.410 4.171 3.933 4.411 0.001 16 0 "[ . 1 . 2]" 1
900 1 43 LYS HB2 1 43 LYS QE . . 4.100 3.357 2.385 4.067 . 0 0 "[ . 1 . 2]" 1
901 1 43 LYS HB2 1 44 LEU H . . 3.600 2.442 2.318 2.574 . 0 0 "[ . 1 . 2]" 1
902 1 43 LYS HB2 1 45 GLY H . . 5.490 5.282 5.095 5.468 . 0 0 "[ . 1 . 2]" 1
903 1 43 LYS HB2 1 47 MET QG . . 4.580 4.449 4.206 4.585 0.005 12 0 "[ . 1 . 2]" 1
904 1 43 LYS HB3 1 43 LYS QE . . 4.900 3.245 2.154 4.268 . 0 0 "[ . 1 . 2]" 1
905 1 43 LYS HB3 1 44 LEU H . . 3.370 3.007 2.839 3.288 . 0 0 "[ . 1 . 2]" 1
906 1 43 LYS HB3 1 47 MET H . . 5.170 4.652 4.431 4.896 . 0 0 "[ . 1 . 2]" 1
907 1 43 LYS HB3 1 47 MET QG . . 4.480 3.119 2.866 3.571 . 0 0 "[ . 1 . 2]" 1
908 1 43 LYS QD 1 44 LEU H . . 5.340 4.450 4.000 4.655 . 0 0 "[ . 1 . 2]" 1
909 1 43 LYS QE 1 43 LYS QG . . 3.280 2.273 2.039 2.727 . 0 0 "[ . 1 . 2]" 1
910 1 43 LYS QG 1 44 LEU H . . 4.860 4.187 4.066 4.261 . 0 0 "[ . 1 . 2]" 1
911 1 44 LEU H 1 44 LEU HB2 . . 3.130 2.493 2.376 2.611 . 0 0 "[ . 1 . 2]" 1
912 1 44 LEU H 1 44 LEU HB3 . . 3.780 3.598 3.579 3.615 . 0 0 "[ . 1 . 2]" 1
913 1 44 LEU H 1 44 LEU MD1 . . 3.880 3.545 3.279 3.821 . 0 0 "[ . 1 . 2]" 1
914 1 44 LEU H 1 44 LEU MD2 . . 3.870 3.453 3.224 3.686 . 0 0 "[ . 1 . 2]" 1
915 1 44 LEU H 1 44 LEU HG . . 3.130 2.306 2.063 2.565 . 0 0 "[ . 1 . 2]" 1
916 1 44 LEU H 1 45 GLY H . . 3.430 3.128 3.016 3.249 . 0 0 "[ . 1 . 2]" 1
917 1 44 LEU H 1 46 GLU H . . 4.880 4.480 4.311 4.886 0.006 12 0 "[ . 1 . 2]" 1
918 1 44 LEU H 1 47 MET ME . . 5.340 4.474 3.926 5.361 0.021 17 0 "[ . 1 . 2]" 1
919 1 44 LEU HA 1 44 LEU MD1 . . 4.360 3.860 3.789 3.922 . 0 0 "[ . 1 . 2]" 1
920 1 44 LEU HA 1 44 LEU MD2 . . 2.940 2.200 2.005 2.462 . 0 0 "[ . 1 . 2]" 1
921 1 44 LEU HA 1 47 MET H . . 3.930 3.557 3.435 3.718 . 0 0 "[ . 1 . 2]" 1
922 1 44 LEU HA 1 47 MET HB2 . . 3.640 2.814 2.615 3.182 . 0 0 "[ . 1 . 2]" 1
923 1 44 LEU HA 1 47 MET HB3 . . 4.620 4.312 4.078 4.612 . 0 0 "[ . 1 . 2]" 1
924 1 44 LEU HA 1 47 MET ME . . 4.180 2.793 2.098 4.009 . 0 0 "[ . 1 . 2]" 1
925 1 44 LEU HA 1 47 MET HG2 . . 4.610 4.299 3.767 4.578 . 0 0 "[ . 1 . 2]" 1
926 1 44 LEU HA 1 47 MET HG3 . . 4.610 2.679 2.288 3.153 . 0 0 "[ . 1 . 2]" 1
927 1 44 LEU HA 1 48 TRP H . . 4.750 4.072 3.883 4.515 . 0 0 "[ . 1 . 2]" 1
928 1 44 LEU HB2 1 44 LEU MD1 . . 3.560 2.293 2.192 2.443 . 0 0 "[ . 1 . 2]" 1
929 1 44 LEU HB2 1 45 GLY H . . 3.740 2.292 2.123 2.525 . 0 0 "[ . 1 . 2]" 1
930 1 44 LEU HB2 1 45 GLY HA3 . . 4.940 4.488 4.348 4.688 . 0 0 "[ . 1 . 2]" 1
931 1 44 LEU HB3 1 44 LEU MD1 . . 3.200 2.398 2.226 2.557 . 0 0 "[ . 1 . 2]" 1
932 1 44 LEU HB3 1 44 LEU MD2 . . 3.210 2.237 2.079 2.356 . 0 0 "[ . 1 . 2]" 1
933 1 44 LEU HB3 1 45 GLY H . . 4.210 3.122 2.828 3.355 . 0 0 "[ . 1 . 2]" 1
934 1 44 LEU MD1 1 45 GLY H . . 5.230 4.169 3.940 4.453 . 0 0 "[ . 1 . 2]" 1
935 1 44 LEU MD2 1 45 GLY H . . 4.930 4.551 4.427 4.624 . 0 0 "[ . 1 . 2]" 1
936 1 44 LEU MD2 1 47 MET H . . 5.420 5.120 4.794 5.404 . 0 0 "[ . 1 . 2]" 1
937 1 44 LEU MD2 1 47 MET HB2 . . 4.710 3.740 3.489 3.906 . 0 0 "[ . 1 . 2]" 1
938 1 44 LEU MD2 1 47 MET ME . . 3.410 2.546 2.026 3.415 0.005 16 0 "[ . 1 . 2]" 1
939 1 44 LEU MD2 1 48 TRP H . . 5.500 4.958 4.675 5.142 . 0 0 "[ . 1 . 2]" 1
940 1 45 GLY H 1 46 GLU H . . 3.290 3.010 2.874 3.150 . 0 0 "[ . 1 . 2]" 1
941 1 45 GLY H 1 46 GLU HB2 . . 5.160 4.941 4.810 5.023 . 0 0 "[ . 1 . 2]" 1
942 1 45 GLY H 1 47 MET H . . 4.690 4.521 4.125 4.688 . 0 0 "[ . 1 . 2]" 1
943 1 45 GLY HA2 1 47 MET H . . 5.190 4.807 4.253 5.045 . 0 0 "[ . 1 . 2]" 1
944 1 45 GLY HA2 1 48 TRP H . . 4.610 3.822 3.644 3.929 . 0 0 "[ . 1 . 2]" 1
945 1 45 GLY HA2 1 48 TRP QB . . 3.980 2.997 2.772 3.287 . 0 0 "[ . 1 . 2]" 1
946 1 45 GLY HA3 1 46 GLU H . . 3.470 2.727 2.540 2.842 . 0 0 "[ . 1 . 2]" 1
947 1 45 GLY HA3 1 47 MET H . . 5.100 4.902 4.507 5.100 . 0 0 "[ . 1 . 2]" 1
948 1 45 GLY HA3 1 48 TRP H . . 4.950 4.878 4.654 4.975 0.025 12 0 "[ . 1 . 2]" 1
949 1 45 GLY HA3 1 48 TRP QB . . 4.620 4.382 4.177 4.624 0.004 5 0 "[ . 1 . 2]" 1
950 1 46 GLU H 1 46 GLU HB2 . . 3.070 2.215 2.184 2.359 . 0 0 "[ . 1 . 2]" 1
951 1 46 GLU H 1 46 GLU HB3 . . 3.520 3.509 3.491 3.569 0.049 16 0 "[ . 1 . 2]" 1
952 1 46 GLU H 1 46 GLU HG2 . . 3.820 3.037 2.781 3.824 0.004 16 0 "[ . 1 . 2]" 1
953 1 46 GLU H 1 46 GLU QG . . 3.300 2.843 2.646 3.292 . 0 0 "[ . 1 . 2]" 1
954 1 46 GLU H 1 46 GLU HG3 . . 3.820 3.619 2.762 3.786 . 0 0 "[ . 1 . 2]" 1
955 1 46 GLU H 1 47 MET H . . 3.210 2.753 2.651 2.906 . 0 0 "[ . 1 . 2]" 1
956 1 46 GLU HA 1 46 GLU HG2 . . 3.650 2.491 2.198 3.653 0.003 16 0 "[ . 1 . 2]" 1
957 1 46 GLU HA 1 46 GLU HG3 . . 3.650 3.525 2.418 3.644 . 0 0 "[ . 1 . 2]" 1
958 1 46 GLU HA 1 49 ASN H . . 3.790 3.642 3.492 3.790 0.000 4 0 "[ . 1 . 2]" 1
959 1 46 GLU HA 1 49 ASN HB2 . . 3.850 3.666 3.472 3.849 . 0 0 "[ . 1 . 2]" 1
960 1 46 GLU HA 1 49 ASN QB . . 3.310 3.064 2.872 3.263 . 0 0 "[ . 1 . 2]" 1
961 1 46 GLU HA 1 49 ASN HB3 . . 3.850 3.305 2.993 3.623 . 0 0 "[ . 1 . 2]" 1
962 1 46 GLU HA 1 50 ASN H . . 4.940 4.248 4.071 4.606 . 0 0 "[ . 1 . 2]" 1
963 1 46 GLU HA 1 50 ASN QD . . 4.340 3.475 3.290 3.782 . 0 0 "[ . 1 . 2]" 1
964 1 46 GLU HB2 1 47 MET H . . 3.450 2.624 2.502 2.877 . 0 0 "[ . 1 . 2]" 1
965 1 46 GLU HB2 1 47 MET HA . . 4.720 4.615 4.435 4.689 . 0 0 "[ . 1 . 2]" 1
966 1 46 GLU HB2 1 47 MET QG . . 5.140 3.583 3.433 3.720 . 0 0 "[ . 1 . 2]" 1
967 1 46 GLU HB2 1 50 ASN HD21 . . 5.500 4.392 3.809 4.771 . 0 0 "[ . 1 . 2]" 1
968 1 46 GLU HB2 1 50 ASN QD . . 4.800 4.059 3.532 4.358 . 0 0 "[ . 1 . 2]" 1
969 1 46 GLU HB2 1 50 ASN HD22 . . 5.500 4.780 4.179 5.038 . 0 0 "[ . 1 . 2]" 1
970 1 46 GLU HB3 1 47 MET H . . 3.610 3.103 2.921 3.585 . 0 0 "[ . 1 . 2]" 1
971 1 46 GLU HB3 1 47 MET QG . . 4.870 3.932 3.779 4.324 . 0 0 "[ . 1 . 2]" 1
972 1 46 GLU QG 1 47 MET H . . 4.470 4.253 4.180 4.495 0.025 16 0 "[ . 1 . 2]" 1
973 1 46 GLU HG2 1 47 MET H . . 5.080 4.728 4.637 5.064 . 0 0 "[ . 1 . 2]" 1
974 1 46 GLU HG2 1 50 ASN HD21 . . 5.500 5.307 4.625 5.485 . 0 0 "[ . 1 . 2]" 1
975 1 46 GLU HG2 1 50 ASN HD22 . . 5.500 5.325 4.342 5.492 . 0 0 "[ . 1 . 2]" 1
976 1 46 GLU HG3 1 47 MET H . . 5.080 4.829 4.581 5.058 . 0 0 "[ . 1 . 2]" 1
977 1 46 GLU HG3 1 50 ASN HD21 . . 5.500 5.439 5.081 5.503 0.003 12 0 "[ . 1 . 2]" 1
978 1 46 GLU HG3 1 50 ASN HD22 . . 5.500 5.187 4.961 5.464 . 0 0 "[ . 1 . 2]" 1
979 1 47 MET H 1 47 MET HB2 . . 3.210 2.687 2.622 2.776 . 0 0 "[ . 1 . 2]" 1
980 1 47 MET H 1 47 MET HB3 . . 3.620 3.583 3.566 3.595 . 0 0 "[ . 1 . 2]" 1
981 1 47 MET H 1 47 MET ME . . 5.410 4.175 3.930 4.623 . 0 0 "[ . 1 . 2]" 1
982 1 47 MET H 1 47 MET HG2 . . 3.790 2.724 2.428 3.231 . 0 0 "[ . 1 . 2]" 1
983 1 47 MET H 1 47 MET QG . . 3.010 2.048 1.870 2.171 . 0 0 "[ . 1 . 2]" 1
984 1 47 MET H 1 47 MET HG3 . . 3.790 2.140 1.889 2.283 . 0 0 "[ . 1 . 2]" 1
985 1 47 MET H 1 48 TRP H . . 3.300 2.849 2.751 2.984 . 0 0 "[ . 1 . 2]" 1
986 1 47 MET H 1 48 TRP QB . . 4.640 4.563 4.487 4.641 0.001 4 0 "[ . 1 . 2]" 1
987 1 47 MET H 1 49 ASN H . . 5.120 4.629 4.284 4.990 . 0 0 "[ . 1 . 2]" 1
988 1 47 MET H 1 50 ASN H . . 5.130 4.814 4.587 4.941 . 0 0 "[ . 1 . 2]" 1
989 1 47 MET HA 1 47 MET ME . . 4.500 4.256 3.862 4.445 . 0 0 "[ . 1 . 2]" 1
990 1 47 MET HA 1 47 MET HG2 . . 3.610 2.532 2.448 2.703 . 0 0 "[ . 1 . 2]" 1
991 1 47 MET HA 1 47 MET QG . . 3.130 2.463 2.401 2.552 . 0 0 "[ . 1 . 2]" 1
992 1 47 MET HA 1 47 MET HG3 . . 3.610 3.423 3.058 3.571 . 0 0 "[ . 1 . 2]" 1
993 1 47 MET HA 1 49 ASN H . . 5.240 4.855 4.482 5.221 . 0 0 "[ . 1 . 2]" 1
994 1 47 MET HA 1 50 ASN H . . 3.980 3.580 3.321 3.781 . 0 0 "[ . 1 . 2]" 1
995 1 47 MET HA 1 50 ASN HB2 . . 3.690 2.464 2.162 2.636 . 0 0 "[ . 1 . 2]" 1
996 1 47 MET HA 1 50 ASN HB3 . . 4.350 3.922 3.547 4.092 . 0 0 "[ . 1 . 2]" 1
997 1 47 MET HA 1 50 ASN QD . . 4.450 2.615 2.244 3.273 . 0 0 "[ . 1 . 2]" 1
998 1 47 MET HA 1 51 LEU H . . 5.500 4.466 4.266 4.602 . 0 0 "[ . 1 . 2]" 1
999 1 47 MET HB2 1 47 MET ME . . 4.100 2.500 1.992 3.920 . 0 0 "[ . 1 . 2]" 1
1000 1 47 MET HB2 1 48 TRP H . . 3.690 2.545 2.143 2.898 . 0 0 "[ . 1 . 2]" 1
1001 1 47 MET HB3 1 47 MET ME . . 3.090 2.532 2.204 3.074 . 0 0 "[ . 1 . 2]" 1
1002 1 47 MET HB3 1 48 TRP H . . 4.000 3.719 3.349 3.994 . 0 0 "[ . 1 . 2]" 1
1003 1 47 MET HB3 1 48 TRP HA . . 5.370 4.551 4.394 4.676 . 0 0 "[ . 1 . 2]" 1
1004 1 47 MET ME 1 47 MET HG2 . . 3.570 3.103 2.227 3.399 . 0 0 "[ . 1 . 2]" 1
1005 1 47 MET ME 1 47 MET QG . . 2.930 2.402 2.183 2.548 . 0 0 "[ . 1 . 2]" 1
1006 1 47 MET ME 1 47 MET HG3 . . 3.570 2.709 2.410 3.384 . 0 0 "[ . 1 . 2]" 1
1007 1 47 MET HG2 1 48 TRP H . . 4.720 4.698 4.553 4.794 0.074 17 0 "[ . 1 . 2]" 1
1008 1 47 MET HG3 1 48 TRP H . . 4.720 4.095 3.864 4.298 . 0 0 "[ . 1 . 2]" 1
1009 1 48 TRP H 1 48 TRP QB . . 2.910 2.247 2.214 2.264 . 0 0 "[ . 1 . 2]" 1
1010 1 48 TRP H 1 48 TRP HD1 . . 5.150 4.990 4.700 5.153 0.003 16 0 "[ . 1 . 2]" 1
1011 1 48 TRP H 1 48 TRP HE3 . . 5.110 4.625 4.371 4.983 . 0 0 "[ . 1 . 2]" 1
1012 1 48 TRP H 1 49 ASN H . . 3.320 2.882 2.694 3.033 . 0 0 "[ . 1 . 2]" 1
1013 1 48 TRP H 1 50 ASN H . . 4.610 3.974 3.765 4.361 . 0 0 "[ . 1 . 2]" 1
1014 1 48 TRP H 1 51 LEU HG . . 5.280 5.033 4.855 5.189 . 0 0 "[ . 1 . 2]" 1
1015 1 48 TRP HA 1 48 TRP HE3 . . 3.470 2.392 2.077 2.671 . 0 0 "[ . 1 . 2]" 1
1016 1 48 TRP HA 1 50 ASN H . . 4.620 4.207 3.871 4.623 0.003 12 0 "[ . 1 . 2]" 1
1017 1 48 TRP HA 1 51 LEU H . . 4.310 3.511 3.294 3.740 . 0 0 "[ . 1 . 2]" 1
1018 1 48 TRP HA 1 51 LEU HB2 . . 4.480 3.322 2.870 3.615 . 0 0 "[ . 1 . 2]" 1
1019 1 48 TRP HA 1 51 LEU HB3 . . 5.180 4.761 4.386 4.971 . 0 0 "[ . 1 . 2]" 1
1020 1 48 TRP HA 1 51 LEU MD1 . . 3.460 2.035 1.927 2.256 . 0 0 "[ . 1 . 2]" 1
1021 1 48 TRP HA 1 51 LEU MD2 . . 4.660 4.425 4.171 4.628 . 0 0 "[ . 1 . 2]" 1
1022 1 48 TRP HA 1 51 LEU HG . . 3.440 3.209 2.922 3.439 . 0 0 "[ . 1 . 2]" 1
1023 1 48 TRP HA 1 56 LYS QE . . 4.830 3.656 3.126 4.660 . 0 0 "[ . 1 . 2]" 1
1024 1 48 TRP QB 1 49 ASN H . . 3.140 2.270 2.069 2.436 . 0 0 "[ . 1 . 2]" 1
1025 1 48 TRP QB 1 50 ASN H . . 4.860 4.462 4.253 4.738 . 0 0 "[ . 1 . 2]" 1
1026 1 48 TRP HD1 1 49 ASN H . . 4.080 3.498 2.997 3.960 . 0 0 "[ . 1 . 2]" 1
1027 1 48 TRP HD1 1 49 ASN HA . . 4.900 3.776 3.392 4.256 . 0 0 "[ . 1 . 2]" 1
1028 1 48 TRP HD1 1 49 ASN QB . . 5.330 3.932 3.517 4.275 . 0 0 "[ . 1 . 2]" 1
1029 1 48 TRP HD1 1 56 LYS QE . . 4.540 4.160 3.632 4.539 . 0 0 "[ . 1 . 2]" 1
1030 1 48 TRP HE1 1 56 LYS HD3 . . 5.200 3.988 3.514 4.621 . 0 0 "[ . 1 . 2]" 1
1031 1 48 TRP HE1 1 56 LYS QE . . 4.040 3.606 3.094 3.909 . 0 0 "[ . 1 . 2]" 1
1032 1 48 TRP HE3 1 51 LEU MD1 . . 3.760 2.111 1.860 2.317 . 0 0 "[ . 1 . 2]" 1
1033 1 48 TRP HE3 1 51 LEU MD2 . . 5.000 4.668 4.446 4.884 . 0 0 "[ . 1 . 2]" 1
1034 1 48 TRP HH2 1 56 LYS HA . . 4.650 3.510 3.230 4.020 . 0 0 "[ . 1 . 2]" 1
1035 1 48 TRP HH2 1 56 LYS QB . . 4.430 2.390 1.992 2.867 . 0 0 "[ . 1 . 2]" 1
1036 1 48 TRP HH2 1 56 LYS HD3 . . 5.500 3.277 2.862 3.923 . 0 0 "[ . 1 . 2]" 1
1037 1 48 TRP HH2 1 56 LYS QG . . 5.160 2.864 2.442 3.863 . 0 0 "[ . 1 . 2]" 1
1038 1 48 TRP HH2 1 59 TYR HB2 . . 4.200 3.261 2.914 3.517 . 0 0 "[ . 1 . 2]" 1
1039 1 48 TRP HH2 1 59 TYR HB3 . . 4.450 3.178 2.951 3.498 . 0 0 "[ . 1 . 2]" 1
1040 1 48 TRP HH2 1 60 ILE H . . 4.830 4.729 4.177 4.832 0.002 19 0 "[ . 1 . 2]" 1
1041 1 48 TRP HH2 1 60 ILE MD . . 3.920 3.749 3.380 3.919 . 0 0 "[ . 1 . 2]" 1
1042 1 48 TRP HH2 1 60 ILE HG12 . . 4.790 3.562 3.109 3.867 . 0 0 "[ . 1 . 2]" 1
1043 1 48 TRP HH2 1 60 ILE HG13 . . 4.300 3.118 2.621 3.339 . 0 0 "[ . 1 . 2]" 1
1044 1 48 TRP HH2 1 60 ILE MG . . 5.500 5.249 4.854 5.495 . 0 0 "[ . 1 . 2]" 1
1045 1 48 TRP HZ2 1 56 LYS QB . . 4.760 3.477 2.758 3.919 . 0 0 "[ . 1 . 2]" 1
1046 1 48 TRP HZ2 1 56 LYS HD2 . . 5.050 4.329 4.011 5.034 . 0 0 "[ . 1 . 2]" 1
1047 1 48 TRP HZ2 1 56 LYS HD3 . . 4.390 2.618 2.331 3.322 . 0 0 "[ . 1 . 2]" 1
1048 1 48 TRP HZ2 1 56 LYS QE . . 4.070 3.628 3.163 4.065 . 0 0 "[ . 1 . 2]" 1
1049 1 48 TRP HZ2 1 56 LYS QG . . 5.340 3.786 3.313 4.497 . 0 0 "[ . 1 . 2]" 1
1050 1 48 TRP HZ2 1 60 ILE MD . . 4.280 3.708 2.888 4.079 . 0 0 "[ . 1 . 2]" 1
1051 1 48 TRP HZ2 1 60 ILE HG12 . . 4.960 3.973 3.374 4.224 . 0 0 "[ . 1 . 2]" 1
1052 1 48 TRP HZ2 1 60 ILE HG13 . . 4.800 4.388 3.671 4.646 . 0 0 "[ . 1 . 2]" 1
1053 1 48 TRP HZ3 1 51 LEU MD1 . . 4.480 2.769 2.267 3.106 . 0 0 "[ . 1 . 2]" 1
1054 1 48 TRP HZ3 1 51 LEU MD2 . . 5.120 4.818 4.430 5.112 . 0 0 "[ . 1 . 2]" 1
1055 1 48 TRP HZ3 1 56 LYS HA . . 4.620 3.512 3.189 3.919 . 0 0 "[ . 1 . 2]" 1
1056 1 48 TRP HZ3 1 59 TYR HB2 . . 4.570 3.312 3.137 3.494 . 0 0 "[ . 1 . 2]" 1
1057 1 48 TRP HZ3 1 59 TYR HB3 . . 4.900 3.033 2.748 3.401 . 0 0 "[ . 1 . 2]" 1
1058 1 48 TRP HZ3 1 59 TYR QD . . 4.530 3.396 3.153 3.602 . 0 0 "[ . 1 . 2]" 1
1059 1 48 TRP HZ3 1 59 TYR QE . . 4.910 4.675 4.403 4.905 . 0 0 "[ . 1 . 2]" 1
1060 1 49 ASN H 1 49 ASN HB2 . . 3.190 2.307 2.177 2.507 . 0 0 "[ . 1 . 2]" 1
1061 1 49 ASN H 1 49 ASN QB . . 2.770 2.195 2.127 2.255 . 0 0 "[ . 1 . 2]" 1
1062 1 49 ASN H 1 49 ASN HB3 . . 3.190 2.794 2.556 3.007 . 0 0 "[ . 1 . 2]" 1
1063 1 49 ASN H 1 50 ASN H . . 3.150 2.737 2.543 2.902 . 0 0 "[ . 1 . 2]" 1
1064 1 49 ASN H 1 50 ASN HB2 . . 4.930 4.652 4.458 4.825 . 0 0 "[ . 1 . 2]" 1
1065 1 49 ASN H 1 51 LEU H . . 4.810 4.322 4.112 4.538 . 0 0 "[ . 1 . 2]" 1
1066 1 49 ASN HA 1 51 LEU H . . 4.660 4.280 3.996 4.564 . 0 0 "[ . 1 . 2]" 1
1067 1 49 ASN HA 1 56 LYS QE . . 4.080 3.619 3.150 4.025 . 0 0 "[ . 1 . 2]" 1
1068 1 49 ASN QB 1 50 ASN H . . 3.540 2.733 2.461 3.082 . 0 0 "[ . 1 . 2]" 1
1069 1 49 ASN HB2 1 50 ASN H . . 4.230 3.813 3.602 4.003 . 0 0 "[ . 1 . 2]" 1
1070 1 49 ASN HB3 1 50 ASN H . . 4.230 2.803 2.492 3.225 . 0 0 "[ . 1 . 2]" 1
1071 1 50 ASN H 1 50 ASN HB2 . . 2.960 2.208 2.185 2.261 . 0 0 "[ . 1 . 2]" 1
1072 1 50 ASN H 1 50 ASN HB3 . . 3.740 3.507 3.485 3.538 . 0 0 "[ . 1 . 2]" 1
1073 1 50 ASN H 1 51 LEU H . . 3.060 2.651 2.376 2.845 . 0 0 "[ . 1 . 2]" 1
1074 1 50 ASN H 1 51 LEU HB2 . . 5.150 4.703 4.430 4.870 . 0 0 "[ . 1 . 2]" 1
1075 1 50 ASN H 1 51 LEU HG . . 5.010 4.534 4.299 4.707 . 0 0 "[ . 1 . 2]" 1
1076 1 50 ASN HB2 1 51 LEU H . . 4.140 2.857 2.656 3.103 . 0 0 "[ . 1 . 2]" 1
1077 1 50 ASN HB3 1 51 LEU H . . 4.310 3.357 3.141 3.604 . 0 0 "[ . 1 . 2]" 1
1078 1 51 LEU H 1 51 LEU HB2 . . 3.200 2.428 2.325 2.515 . 0 0 "[ . 1 . 2]" 1
1079 1 51 LEU H 1 51 LEU HB3 . . 3.750 3.580 3.558 3.602 . 0 0 "[ . 1 . 2]" 1
1080 1 51 LEU H 1 51 LEU MD1 . . 4.110 3.403 3.291 3.526 . 0 0 "[ . 1 . 2]" 1
1081 1 51 LEU H 1 51 LEU MD2 . . 4.100 3.665 3.518 3.855 . 0 0 "[ . 1 . 2]" 1
1082 1 51 LEU H 1 51 LEU HG . . 3.350 2.372 2.240 2.583 . 0 0 "[ . 1 . 2]" 1
1083 1 51 LEU H 1 52 ASN H . . 4.710 4.640 4.614 4.650 . 0 0 "[ . 1 . 2]" 1
1084 1 51 LEU H 1 56 LYS QE . . 4.230 3.722 3.503 3.943 . 0 0 "[ . 1 . 2]" 1
1085 1 51 LEU H 1 56 LYS QG . . 5.340 4.950 4.832 5.044 . 0 0 "[ . 1 . 2]" 1
1086 1 51 LEU HA 1 51 LEU MD1 . . 4.090 3.884 3.869 3.906 . 0 0 "[ . 1 . 2]" 1
1087 1 51 LEU HA 1 51 LEU MD2 . . 2.890 2.158 2.019 2.441 . 0 0 "[ . 1 . 2]" 1
1088 1 51 LEU HA 1 51 LEU HG . . 4.100 2.828 2.747 2.913 . 0 0 "[ . 1 . 2]" 1
1089 1 51 LEU HA 1 52 ASN H . . 2.850 2.350 2.270 2.457 . 0 0 "[ . 1 . 2]" 1
1090 1 51 LEU HA 1 52 ASN HA . . 4.910 4.370 4.349 4.396 . 0 0 "[ . 1 . 2]" 1
1091 1 51 LEU HA 1 55 GLU HB2 . . 4.280 3.538 3.346 3.776 . 0 0 "[ . 1 . 2]" 1
1092 1 51 LEU HA 1 55 GLU HB3 . . 4.730 4.169 3.912 4.472 . 0 0 "[ . 1 . 2]" 1
1093 1 51 LEU HA 1 55 GLU HG3 . . 4.850 3.434 3.102 3.814 . 0 0 "[ . 1 . 2]" 1
1094 1 51 LEU HB2 1 51 LEU MD1 . . 3.510 2.150 2.046 2.319 . 0 0 "[ . 1 . 2]" 1
1095 1 51 LEU HB2 1 51 LEU MD2 . . 3.670 3.170 3.148 3.188 . 0 0 "[ . 1 . 2]" 1
1096 1 51 LEU HB2 1 52 ASN H . . 4.350 3.810 3.563 3.966 . 0 0 "[ . 1 . 2]" 1
1097 1 51 LEU HB2 1 55 GLU HB2 . . 4.360 4.090 3.901 4.245 . 0 0 "[ . 1 . 2]" 1
1098 1 51 LEU HB2 1 55 GLU HB3 . . 4.880 4.681 4.488 4.880 . 0 0 "[ . 1 . 2]" 1
1099 1 51 LEU HB2 1 56 LYS H . . 5.260 5.025 4.907 5.154 . 0 0 "[ . 1 . 2]" 1
1100 1 51 LEU HB2 1 56 LYS QB . . 4.950 4.935 4.877 4.954 0.004 17 0 "[ . 1 . 2]" 1
1101 1 51 LEU HB2 1 56 LYS QE . . 3.570 2.086 1.964 2.254 . 0 0 "[ . 1 . 2]" 1
1102 1 51 LEU HB2 1 56 LYS HG2 . . 4.300 3.293 2.934 3.697 . 0 0 "[ . 1 . 2]" 1
1103 1 51 LEU HB2 1 56 LYS QG . . 3.660 2.834 2.783 2.871 . 0 0 "[ . 1 . 2]" 1
1104 1 51 LEU HB2 1 56 LYS HG3 . . 4.300 3.144 2.936 3.461 . 0 0 "[ . 1 . 2]" 1
1105 1 51 LEU HB3 1 51 LEU MD1 . . 3.610 2.524 2.390 2.636 . 0 0 "[ . 1 . 2]" 1
1106 1 51 LEU HB3 1 51 LEU MD2 . . 3.320 2.277 2.089 2.335 . 0 0 "[ . 1 . 2]" 1
1107 1 51 LEU HB3 1 52 ASN H . . 3.730 2.553 2.287 2.767 . 0 0 "[ . 1 . 2]" 1
1108 1 51 LEU HB3 1 55 GLU H . . 4.690 4.379 4.206 4.563 . 0 0 "[ . 1 . 2]" 1
1109 1 51 LEU HB3 1 55 GLU HB2 . . 3.910 2.364 2.178 2.515 . 0 0 "[ . 1 . 2]" 1
1110 1 51 LEU HB3 1 55 GLU HB3 . . 4.200 2.998 2.771 3.179 . 0 0 "[ . 1 . 2]" 1
1111 1 51 LEU HB3 1 55 GLU HG2 . . 5.050 4.720 4.475 4.956 . 0 0 "[ . 1 . 2]" 1
1112 1 51 LEU HB3 1 55 GLU HG3 . . 4.400 3.835 3.624 3.999 . 0 0 "[ . 1 . 2]" 1
1113 1 51 LEU HB3 1 56 LYS H . . 4.290 3.794 3.661 3.886 . 0 0 "[ . 1 . 2]" 1
1114 1 51 LEU HB3 1 56 LYS HA . . 5.140 4.511 4.371 4.651 . 0 0 "[ . 1 . 2]" 1
1115 1 51 LEU HB3 1 56 LYS QB . . 5.010 4.606 4.478 4.766 . 0 0 "[ . 1 . 2]" 1
1116 1 51 LEU HB3 1 56 LYS QE . . 4.010 2.975 2.711 3.341 . 0 0 "[ . 1 . 2]" 1
1117 1 51 LEU HB3 1 56 LYS HG2 . . 4.470 3.345 2.876 3.838 . 0 0 "[ . 1 . 2]" 1
1118 1 51 LEU HB3 1 56 LYS QG . . 3.800 2.505 2.376 2.680 . 0 0 "[ . 1 . 2]" 1
1119 1 51 LEU HB3 1 56 LYS HG3 . . 4.470 2.609 2.440 2.876 . 0 0 "[ . 1 . 2]" 1
1120 1 51 LEU MD1 1 52 ASN H . . 4.930 4.629 4.489 4.808 . 0 0 "[ . 1 . 2]" 1
1121 1 51 LEU MD1 1 55 GLU HB2 . . 4.820 4.071 3.842 4.233 . 0 0 "[ . 1 . 2]" 1
1122 1 51 LEU MD1 1 55 GLU HB3 . . 4.360 3.654 3.376 3.924 . 0 0 "[ . 1 . 2]" 1
1123 1 51 LEU MD1 1 56 LYS H . . 4.770 4.677 4.475 4.769 . 0 0 "[ . 1 . 2]" 1
1124 1 51 LEU MD1 1 56 LYS HA . . 3.960 3.781 3.600 3.959 . 0 0 "[ . 1 . 2]" 1
1125 1 51 LEU MD1 1 56 LYS QB . . 5.080 4.310 4.144 4.510 . 0 0 "[ . 1 . 2]" 1
1126 1 51 LEU MD1 1 56 LYS QE . . 4.250 2.920 2.532 3.455 . 0 0 "[ . 1 . 2]" 1
1127 1 51 LEU MD1 1 56 LYS QG . . 3.780 2.580 2.419 2.792 . 0 0 "[ . 1 . 2]" 1
1128 1 51 LEU MD1 1 59 TYR QD . . 4.390 3.267 3.056 3.487 . 0 0 "[ . 1 . 2]" 1
1129 1 51 LEU MD1 1 59 TYR QE . . 4.240 3.210 3.011 3.415 . 0 0 "[ . 1 . 2]" 1
1130 1 51 LEU MD2 1 52 ASN H . . 3.880 3.087 2.863 3.238 . 0 0 "[ . 1 . 2]" 1
1131 1 51 LEU MD2 1 55 GLU H . . 4.990 4.740 4.576 4.912 . 0 0 "[ . 1 . 2]" 1
1132 1 51 LEU MD2 1 55 GLU HA . . 4.820 4.248 4.039 4.451 . 0 0 "[ . 1 . 2]" 1
1133 1 51 LEU MD2 1 55 GLU HB2 . . 3.700 2.766 2.579 2.950 . 0 0 "[ . 1 . 2]" 1
1134 1 51 LEU MD2 1 55 GLU HB3 . . 3.290 2.051 1.928 2.273 . 0 0 "[ . 1 . 2]" 1
1135 1 51 LEU MD2 1 55 GLU HG2 . . 4.730 3.975 3.736 4.234 . 0 0 "[ . 1 . 2]" 1
1136 1 51 LEU MD2 1 55 GLU HG3 . . 3.980 2.728 2.389 3.700 . 0 0 "[ . 1 . 2]" 1
1137 1 51 LEU MD2 1 56 LYS H . . 5.060 4.577 4.426 4.700 . 0 0 "[ . 1 . 2]" 1
1138 1 51 LEU MD2 1 56 LYS HA . . 4.640 4.559 4.384 4.642 0.002 12 0 "[ . 1 . 2]" 1
1139 1 51 LEU MD2 1 56 LYS QE . . 4.660 4.399 4.229 4.660 . 9 0 "[ . 1 . 2]" 1
1140 1 51 LEU MD2 1 56 LYS QG . . 4.480 3.764 3.623 3.870 . 0 0 "[ . 1 . 2]" 1
1141 1 51 LEU MD2 1 59 TYR QD . . 4.480 3.756 3.520 3.896 . 0 0 "[ . 1 . 2]" 1
1142 1 51 LEU MD2 1 59 TYR QE . . 4.320 2.947 2.714 3.199 . 0 0 "[ . 1 . 2]" 1
1143 1 51 LEU HG 1 52 ASN H . . 5.030 4.694 4.564 4.825 . 0 0 "[ . 1 . 2]" 1
1144 1 52 ASN H 1 52 ASN HB2 . . 3.910 2.728 2.354 3.627 . 0 0 "[ . 1 . 2]" 1
1145 1 52 ASN H 1 52 ASN HB3 . . 3.910 3.229 2.357 3.720 . 0 0 "[ . 1 . 2]" 1
1146 1 52 ASN H 1 52 ASN QD . . 4.900 3.581 2.427 4.718 . 0 0 "[ . 1 . 2]" 1
1147 1 52 ASN H 1 55 GLU H . . 4.460 3.283 3.129 3.469 . 0 0 "[ . 1 . 2]" 1
1148 1 52 ASN H 1 55 GLU HB2 . . 3.470 1.987 1.899 2.156 . 0 0 "[ . 1 . 2]" 1
1149 1 52 ASN H 1 55 GLU HB3 . . 4.110 3.414 3.276 3.543 . 0 0 "[ . 1 . 2]" 1
1150 1 52 ASN H 1 55 GLU HG2 . . 4.370 3.134 2.773 3.514 . 0 0 "[ . 1 . 2]" 1
1151 1 52 ASN H 1 55 GLU HG3 . . 4.320 2.499 1.898 2.868 . 0 0 "[ . 1 . 2]" 1
1152 1 52 ASN H 1 56 LYS H . . 4.770 4.192 3.999 4.450 . 0 0 "[ . 1 . 2]" 1
1153 1 52 ASN HA 1 53 ASP HA . . 4.630 4.296 4.292 4.302 . 0 0 "[ . 1 . 2]" 1
1154 1 52 ASN QB 1 53 ASP H . . 4.230 2.768 2.183 3.429 . 0 0 "[ . 1 . 2]" 1
1155 1 52 ASN QB 1 55 GLU H . . 4.480 2.747 2.548 3.426 . 0 0 "[ . 1 . 2]" 1
1156 1 52 ASN QB 1 55 GLU HB2 . . 5.220 3.310 3.089 4.163 . 0 0 "[ . 1 . 2]" 1
1157 1 52 ASN QB 1 55 GLU HG3 . . 5.340 3.264 2.031 4.459 . 0 0 "[ . 1 . 2]" 1
1158 1 52 ASN HB2 1 53 ASP H . . 4.970 3.628 2.511 4.004 . 0 0 "[ . 1 . 2]" 1
1159 1 52 ASN HB2 1 55 GLU H . . 5.190 3.371 2.641 4.501 . 0 0 "[ . 1 . 2]" 1
1160 1 52 ASN HB3 1 53 ASP H . . 4.970 2.986 2.203 3.807 . 0 0 "[ . 1 . 2]" 1
1161 1 52 ASN HB3 1 55 GLU H . . 5.190 3.448 2.571 4.509 . 0 0 "[ . 1 . 2]" 1
1162 1 52 ASN QD 1 55 GLU HG2 . . 4.730 3.299 2.336 4.378 . 0 0 "[ . 1 . 2]" 1
1163 1 53 ASP HA 1 55 GLU H . . 4.540 4.155 3.940 4.329 . 0 0 "[ . 1 . 2]" 1
1164 1 53 ASP HA 1 56 LYS H . . 3.890 3.570 3.366 3.713 . 0 0 "[ . 1 . 2]" 1
1165 1 53 ASP HA 1 56 LYS QB . . 3.550 3.106 2.745 3.433 . 0 0 "[ . 1 . 2]" 1
1166 1 53 ASP HA 1 56 LYS HD2 . . 3.920 3.018 2.545 3.248 . 0 0 "[ . 1 . 2]" 1
1167 1 53 ASP HA 1 56 LYS HD3 . . 5.050 4.581 4.008 4.975 . 0 0 "[ . 1 . 2]" 1
1168 1 53 ASP HA 1 56 LYS QE . . 5.250 4.625 4.296 5.017 . 0 0 "[ . 1 . 2]" 1
1169 1 53 ASP QB 1 54 SER H . . 4.220 3.034 2.431 3.592 . 0 0 "[ . 1 . 2]" 1
1170 1 53 ASP HB2 1 54 SER H . . 4.960 3.481 2.476 4.386 . 0 0 "[ . 1 . 2]" 1
1171 1 53 ASP HB3 1 54 SER H . . 4.960 3.709 3.019 4.322 . 0 0 "[ . 1 . 2]" 1
1172 1 54 SER H 1 55 GLU H . . 4.190 2.341 2.158 2.652 . 0 0 "[ . 1 . 2]" 1
1173 1 54 SER HA 1 57 GLN H . . 3.890 3.449 3.386 3.507 . 0 0 "[ . 1 . 2]" 1
1174 1 54 SER HA 1 57 GLN HB2 . . 3.850 2.938 2.730 3.041 . 0 0 "[ . 1 . 2]" 1
1175 1 54 SER HA 1 57 GLN HB3 . . 4.430 4.319 4.084 4.434 0.004 17 0 "[ . 1 . 2]" 1
1176 1 54 SER HA 1 57 GLN HG2 . . 4.410 2.834 2.510 3.046 . 0 0 "[ . 1 . 2]" 1
1177 1 54 SER HA 1 57 GLN HG3 . . 4.410 2.611 2.380 2.845 . 0 0 "[ . 1 . 2]" 1
1178 1 54 SER HA 1 58 PRO HD3 . . 4.700 4.524 4.290 4.616 . 0 0 "[ . 1 . 2]" 1
1179 1 54 SER QB 1 55 GLU H . . 3.960 2.977 2.712 3.633 . 0 0 "[ . 1 . 2]" 1
1180 1 54 SER HB2 1 55 GLU H . . 4.560 3.624 2.902 4.288 . 0 0 "[ . 1 . 2]" 1
1181 1 54 SER HB2 1 55 GLU HG2 . . 5.500 4.564 3.481 5.443 . 0 0 "[ . 1 . 2]" 1
1182 1 54 SER HB3 1 55 GLU H . . 4.560 3.396 2.765 3.992 . 0 0 "[ . 1 . 2]" 1
1183 1 54 SER HB3 1 55 GLU HG2 . . 5.500 4.010 3.344 5.227 . 0 0 "[ . 1 . 2]" 1
1184 1 55 GLU H 1 55 GLU HB2 . . 3.120 2.344 2.281 2.595 . 0 0 "[ . 1 . 2]" 1
1185 1 55 GLU H 1 55 GLU HB3 . . 3.720 3.576 3.552 3.612 . 0 0 "[ . 1 . 2]" 1
1186 1 55 GLU H 1 55 GLU HG2 . . 3.310 2.671 2.481 2.842 . 0 0 "[ . 1 . 2]" 1
1187 1 55 GLU H 1 55 GLU HG3 . . 3.970 3.707 2.391 3.912 . 0 0 "[ . 1 . 2]" 1
1188 1 55 GLU H 1 56 LYS QB . . 5.160 4.533 4.417 4.653 . 0 0 "[ . 1 . 2]" 1
1189 1 55 GLU H 1 57 GLN H . . 4.330 3.737 3.636 3.811 . 0 0 "[ . 1 . 2]" 1
1190 1 55 GLU H 1 58 PRO HD2 . . 5.500 4.658 4.623 4.687 . 0 0 "[ . 1 . 2]" 1
1191 1 55 GLU H 1 58 PRO HD3 . . 5.500 5.488 5.420 5.505 0.005 9 0 "[ . 1 . 2]" 1
1192 1 55 GLU HA 1 55 GLU HG2 . . 3.510 2.789 2.507 2.957 . 0 0 "[ . 1 . 2]" 1
1193 1 55 GLU HA 1 55 GLU HG3 . . 3.790 3.703 3.533 3.746 . 0 0 "[ . 1 . 2]" 1
1194 1 55 GLU HA 1 57 GLN H . . 4.810 4.044 3.968 4.114 . 0 0 "[ . 1 . 2]" 1
1195 1 55 GLU HA 1 58 PRO HD2 . . 4.060 3.330 3.232 3.433 . 0 0 "[ . 1 . 2]" 1
1196 1 55 GLU HA 1 58 PRO HD3 . . 4.240 4.061 3.953 4.176 . 0 0 "[ . 1 . 2]" 1
1197 1 55 GLU HA 1 59 TYR QE . . 5.500 4.784 4.576 5.010 . 0 0 "[ . 1 . 2]" 1
1198 1 55 GLU HB2 1 56 LYS H . . 3.630 2.814 2.659 2.873 . 0 0 "[ . 1 . 2]" 1
1199 1 55 GLU HB3 1 56 LYS H . . 4.290 3.655 3.604 3.825 . 0 0 "[ . 1 . 2]" 1
1200 1 55 GLU HB3 1 57 GLN H . . 5.500 5.304 5.232 5.454 . 0 0 "[ . 1 . 2]" 1
1201 1 55 GLU HG2 1 56 LYS H . . 4.640 4.552 4.439 4.644 0.004 12 0 "[ . 1 . 2]" 1
1202 1 56 LYS H 1 56 LYS QB . . 3.210 2.463 2.314 2.588 . 0 0 "[ . 1 . 2]" 1
1203 1 56 LYS H 1 56 LYS HD2 . . 4.630 3.847 3.379 3.981 . 0 0 "[ . 1 . 2]" 1
1204 1 56 LYS H 1 56 LYS HD3 . . 5.040 4.704 4.383 4.892 . 0 0 "[ . 1 . 2]" 1
1205 1 56 LYS H 1 56 LYS QE . . 4.700 4.431 4.123 4.700 . 0 0 "[ . 1 . 2]" 1
1206 1 56 LYS H 1 56 LYS QG . . 3.390 2.252 1.998 2.590 . 0 0 "[ . 1 . 2]" 1
1207 1 56 LYS H 1 57 GLN H . . 3.040 2.399 2.351 2.430 . 0 0 "[ . 1 . 2]" 1
1208 1 56 LYS H 1 57 GLN HB2 . . 4.580 4.364 4.330 4.387 . 0 0 "[ . 1 . 2]" 1
1209 1 56 LYS H 1 58 PRO HD2 . . 4.940 3.650 3.642 3.660 . 0 0 "[ . 1 . 2]" 1
1210 1 56 LYS H 1 58 PRO HD3 . . 5.040 5.054 5.050 5.061 0.021 8 0 "[ . 1 . 2]" 1
1211 1 56 LYS HA 1 56 LYS HD3 . . 5.310 4.454 4.357 4.604 . 0 0 "[ . 1 . 2]" 1
1212 1 56 LYS HA 1 56 LYS QE . . 5.500 4.687 4.557 5.077 . 0 0 "[ . 1 . 2]" 1
1213 1 56 LYS HA 1 56 LYS HG2 . . 3.970 2.674 2.578 2.905 . 0 0 "[ . 1 . 2]" 1
1214 1 56 LYS HA 1 56 LYS QG . . 3.330 2.502 2.405 2.599 . 0 0 "[ . 1 . 2]" 1
1215 1 56 LYS HA 1 56 LYS HG3 . . 3.970 3.029 2.798 3.247 . 0 0 "[ . 1 . 2]" 1
1216 1 56 LYS HA 1 58 PRO HD2 . . 4.550 3.512 3.475 3.547 . 0 0 "[ . 1 . 2]" 1
1217 1 56 LYS HA 1 59 TYR H . . 4.320 3.143 3.101 3.176 . 0 0 "[ . 1 . 2]" 1
1218 1 56 LYS HA 1 59 TYR HB2 . . 4.410 1.993 1.989 2.004 . 0 0 "[ . 1 . 2]" 1
1219 1 56 LYS HA 1 59 TYR QD . . 3.230 2.028 1.997 2.263 . 0 0 "[ . 1 . 2]" 1
1220 1 56 LYS HA 1 59 TYR QE . . 4.600 4.318 4.287 4.547 . 0 0 "[ . 1 . 2]" 1
1221 1 56 LYS HA 1 60 ILE HG12 . . 5.500 5.447 5.320 5.508 0.008 18 0 "[ . 1 . 2]" 1
1222 1 56 LYS HA 1 60 ILE HG13 . . 4.760 3.886 3.770 3.954 . 0 0 "[ . 1 . 2]" 1
1223 1 56 LYS QB 1 56 LYS HD2 . . 3.660 2.403 2.239 2.675 . 0 0 "[ . 1 . 2]" 1
1224 1 56 LYS QB 1 56 LYS HD3 . . 3.630 2.392 2.213 2.545 . 0 0 "[ . 1 . 2]" 1
1225 1 56 LYS QB 1 57 GLN H . . 3.760 2.998 2.949 3.036 . 0 0 "[ . 1 . 2]" 1
1226 1 56 LYS QB 1 57 GLN HA . . 4.090 3.965 3.927 3.997 . 0 0 "[ . 1 . 2]" 1
1227 1 56 LYS QB 1 59 TYR H . . 4.950 4.167 4.113 4.234 . 0 0 "[ . 1 . 2]" 1
1228 1 56 LYS QB 1 59 TYR HB2 . . 5.100 3.216 3.101 3.384 . 0 0 "[ . 1 . 2]" 1
1229 1 56 LYS QB 1 59 TYR HB3 . . 5.470 4.197 4.075 4.357 . 0 0 "[ . 1 . 2]" 1
1230 1 56 LYS QB 1 59 TYR QD . . 5.270 4.052 3.969 4.271 . 0 0 "[ . 1 . 2]" 1
1231 1 56 LYS QB 1 60 ILE H . . 4.230 4.018 3.924 4.099 . 0 0 "[ . 1 . 2]" 1
1232 1 56 LYS QB 1 60 ILE MD . . 3.210 2.336 2.041 2.551 . 0 0 "[ . 1 . 2]" 1
1233 1 56 LYS QB 1 60 ILE HG13 . . 4.660 2.526 2.417 2.696 . 0 0 "[ . 1 . 2]" 1
1234 1 56 LYS QE 1 56 LYS QG . . 3.220 2.148 2.101 2.432 . 0 0 "[ . 1 . 2]" 1
1235 1 56 LYS QG 1 57 GLN H . . 4.960 4.132 3.933 4.341 . 0 0 "[ . 1 . 2]" 1
1236 1 56 LYS QG 1 59 TYR QD . . 5.340 3.576 3.437 3.772 . 0 0 "[ . 1 . 2]" 1
1237 1 57 GLN H 1 57 GLN HB2 . . 3.070 2.244 2.226 2.256 . 0 0 "[ . 1 . 2]" 1
1238 1 57 GLN H 1 57 GLN HB3 . . 3.590 3.530 3.520 3.538 . 0 0 "[ . 1 . 2]" 1
1239 1 57 GLN H 1 57 GLN HG2 . . 3.990 2.803 2.768 2.845 . 0 0 "[ . 1 . 2]" 1
1240 1 57 GLN H 1 57 GLN HG3 . . 3.990 3.798 3.681 3.933 . 0 0 "[ . 1 . 2]" 1
1241 1 57 GLN H 1 58 PRO HD2 . . 3.750 2.280 2.236 2.311 . 0 0 "[ . 1 . 2]" 1
1242 1 57 GLN H 1 58 PRO HD3 . . 3.650 3.283 3.242 3.312 . 0 0 "[ . 1 . 2]" 1
1243 1 57 GLN H 1 60 ILE HB . . 5.500 5.366 5.233 5.494 . 0 0 "[ . 1 . 2]" 1
1244 1 57 GLN H 1 60 ILE MD . . 4.640 4.014 3.573 4.279 . 0 0 "[ . 1 . 2]" 1
1245 1 57 GLN HA 1 57 GLN HG2 . . 3.870 2.544 2.417 2.714 . 0 0 "[ . 1 . 2]" 1
1246 1 57 GLN HA 1 57 GLN HG3 . . 3.870 3.620 3.609 3.624 . 0 0 "[ . 1 . 2]" 1
1247 1 57 GLN HA 1 59 TYR H . . 5.070 3.922 3.890 3.976 . 0 0 "[ . 1 . 2]" 1
1248 1 57 GLN HA 1 60 ILE H . . 3.810 3.611 3.602 3.620 . 0 0 "[ . 1 . 2]" 1
1249 1 57 GLN HA 1 60 ILE HB . . 3.410 3.277 3.183 3.346 . 0 0 "[ . 1 . 2]" 1
1250 1 57 GLN HA 1 60 ILE MD . . 3.440 3.043 2.712 3.372 . 0 0 "[ . 1 . 2]" 1
1251 1 57 GLN HA 1 60 ILE HG12 . . 5.500 5.401 5.296 5.498 . 0 0 "[ . 1 . 2]" 1
1252 1 57 GLN HA 1 60 ILE HG13 . . 4.240 4.094 3.941 4.238 . 0 0 "[ . 1 . 2]" 1
1253 1 57 GLN HA 1 60 ILE MG . . 4.660 4.607 4.496 4.663 0.003 3 0 "[ . 1 . 2]" 1
1254 1 57 GLN HA 1 61 THR H . . 4.370 4.128 3.945 4.364 . 0 0 "[ . 1 . 2]" 1
1255 1 57 GLN HB2 1 58 PRO HD2 . . 4.260 2.497 2.492 2.504 . 0 0 "[ . 1 . 2]" 1
1256 1 57 GLN HB2 1 58 PRO HD3 . . 3.780 1.971 1.970 1.974 . 0 0 "[ . 1 . 2]" 1
1257 1 57 GLN HB3 1 58 PRO HD2 . . 3.730 3.482 3.476 3.491 . 0 0 "[ . 1 . 2]" 1
1258 1 57 GLN HB3 1 58 PRO HD3 . . 3.430 2.508 2.500 2.518 . 0 0 "[ . 1 . 2]" 1
1259 1 57 GLN QE 1 60 ILE MD . . 4.730 3.168 2.928 3.513 . 0 0 "[ . 1 . 2]" 1
1260 1 57 GLN QE 1 61 THR H . . 5.340 5.147 4.689 5.342 0.002 18 0 "[ . 1 . 2]" 1
1261 1 57 GLN HE21 1 60 ILE MG . . 4.990 4.794 4.548 4.981 . 0 0 "[ . 1 . 2]" 1
1262 1 57 GLN HE22 1 60 ILE MG . . 4.990 4.859 4.493 4.992 0.002 1 0 "[ . 1 . 2]" 1
1263 1 57 GLN QG 1 58 PRO HD3 . . 4.150 3.800 3.793 3.808 . 0 0 "[ . 1 . 2]" 1
1264 1 57 GLN HG2 1 58 PRO HD3 . . 4.710 4.455 4.389 4.504 . 0 0 "[ . 1 . 2]" 1
1265 1 57 GLN HG3 1 58 PRO HD3 . . 4.710 4.122 4.106 4.149 . 0 0 "[ . 1 . 2]" 1
1266 1 58 PRO HA 1 60 ILE H . . 4.950 4.248 4.148 4.324 . 0 0 "[ . 1 . 2]" 1
1267 1 58 PRO HA 1 61 THR H . . 4.280 3.794 3.676 4.014 . 0 0 "[ . 1 . 2]" 1
1268 1 58 PRO HA 1 61 THR HB . . 3.380 3.205 3.024 3.378 . 0 0 "[ . 1 . 2]" 1
1269 1 58 PRO HA 1 62 LYS H . . 4.590 4.279 4.070 4.583 . 0 0 "[ . 1 . 2]" 1
1270 1 58 PRO HB2 1 59 TYR H . . 3.860 3.764 3.723 3.788 . 0 0 "[ . 1 . 2]" 1
1271 1 58 PRO HB3 1 59 TYR H . . 4.430 4.390 4.367 4.404 . 0 0 "[ . 1 . 2]" 1
1272 1 58 PRO HD2 1 59 TYR H . . 3.800 2.813 2.781 2.833 . 0 0 "[ . 1 . 2]" 1
1273 1 58 PRO HD2 1 59 TYR QD . . 4.860 3.935 3.918 3.954 . 0 0 "[ . 1 . 2]" 1
1274 1 58 PRO HD2 1 60 ILE H . . 5.500 4.539 4.479 4.580 . 0 0 "[ . 1 . 2]" 1
1275 1 58 PRO HD3 1 59 TYR H . . 4.160 3.931 3.914 3.941 . 0 0 "[ . 1 . 2]" 1
1276 1 58 PRO HD3 1 59 TYR QD . . 5.500 5.503 5.489 5.509 0.009 16 0 "[ . 1 . 2]" 1
1277 1 58 PRO HD3 1 60 ILE H . . 5.500 5.456 5.381 5.500 . 0 0 "[ . 1 . 2]" 1
1278 1 58 PRO QG 1 59 TYR H . . 4.010 2.940 2.876 2.977 . 0 0 "[ . 1 . 2]" 1
1279 1 58 PRO QG 1 59 TYR QD . . 4.850 3.392 3.300 3.427 . 0 0 "[ . 1 . 2]" 1
1280 1 58 PRO QG 1 59 TYR QE . . 5.200 4.008 3.897 4.077 . 0 0 "[ . 1 . 2]" 1
1281 1 58 PRO HG2 1 59 TYR H . . 4.740 2.989 2.922 3.030 . 0 0 "[ . 1 . 2]" 1
1282 1 58 PRO HG3 1 59 TYR H . . 4.740 4.345 4.294 4.376 . 0 0 "[ . 1 . 2]" 1
1283 1 59 TYR H 1 59 TYR HB2 . . 3.530 2.297 2.269 2.336 . 0 0 "[ . 1 . 2]" 1
1284 1 59 TYR H 1 59 TYR HB3 . . 3.900 3.561 3.534 3.593 . 0 0 "[ . 1 . 2]" 1
1285 1 59 TYR H 1 59 TYR QD . . 3.540 3.426 3.400 3.442 . 0 0 "[ . 1 . 2]" 1
1286 1 59 TYR H 1 60 ILE H . . 3.180 2.174 2.171 2.178 . 0 0 "[ . 1 . 2]" 1
1287 1 59 TYR H 1 60 ILE HB . . 4.550 4.419 4.370 4.483 . 0 0 "[ . 1 . 2]" 1
1288 1 59 TYR H 1 60 ILE MD . . 4.910 4.642 4.322 4.800 . 0 0 "[ . 1 . 2]" 1
1289 1 59 TYR H 1 61 THR H . . 4.530 3.829 3.686 4.047 . 0 0 "[ . 1 . 2]" 1
1290 1 59 TYR HA 1 59 TYR QD . . 3.370 2.263 2.210 2.334 . 0 0 "[ . 1 . 2]" 1
1291 1 59 TYR HA 1 59 TYR QE . . 5.500 4.284 4.279 4.296 . 0 0 "[ . 1 . 2]" 1
1292 1 59 TYR HA 1 62 LYS H . . 4.040 3.921 3.811 4.038 . 0 0 "[ . 1 . 2]" 1
1293 1 59 TYR HA 1 62 LYS QB . . 3.890 3.277 3.127 3.467 . 0 0 "[ . 1 . 2]" 1
1294 1 59 TYR HA 1 62 LYS QD . . 5.340 4.430 3.698 5.313 . 0 0 "[ . 1 . 2]" 1
1295 1 59 TYR HA 1 63 ALA H . . 5.010 4.801 4.464 4.985 . 0 0 "[ . 1 . 2]" 1
1296 1 59 TYR HB2 1 60 ILE H . . 3.720 3.062 2.996 3.136 . 0 0 "[ . 1 . 2]" 1
1297 1 59 TYR HB2 1 60 ILE HA . . 4.910 4.722 4.676 4.769 . 0 0 "[ . 1 . 2]" 1
1298 1 59 TYR HB2 1 60 ILE HG13 . . 5.360 3.413 3.280 3.548 . 0 0 "[ . 1 . 2]" 1
1299 1 59 TYR HB3 1 60 ILE H . . 4.390 3.709 3.624 3.856 . 0 0 "[ . 1 . 2]" 1
1300 1 59 TYR QD 1 60 ILE H . . 4.840 4.677 4.644 4.705 . 0 0 "[ . 1 . 2]" 1
1301 1 60 ILE H 1 60 ILE HB . . 3.120 2.486 2.445 2.544 . 0 0 "[ . 1 . 2]" 1
1302 1 60 ILE H 1 60 ILE MD . . 3.930 3.553 3.372 3.663 . 0 0 "[ . 1 . 2]" 1
1303 1 60 ILE H 1 60 ILE HG12 . . 3.930 3.748 3.653 3.876 . 0 0 "[ . 1 . 2]" 1
1304 1 60 ILE H 1 60 ILE HG13 . . 3.430 2.407 2.323 2.525 . 0 0 "[ . 1 . 2]" 1
1305 1 60 ILE H 1 60 ILE MG . . 3.830 3.775 3.760 3.797 . 0 0 "[ . 1 . 2]" 1
1306 1 60 ILE H 1 61 THR H . . 3.310 2.365 2.281 2.478 . 0 0 "[ . 1 . 2]" 1
1307 1 60 ILE H 1 61 THR HA . . 5.110 5.010 4.949 5.086 . 0 0 "[ . 1 . 2]" 1
1308 1 60 ILE HA 1 60 ILE HG12 . . 3.270 2.626 2.563 2.762 . 0 0 "[ . 1 . 2]" 1
1309 1 60 ILE HA 1 60 ILE HG13 . . 3.740 2.870 2.770 2.986 . 0 0 "[ . 1 . 2]" 1
1310 1 60 ILE HA 1 60 ILE MG . . 3.190 2.427 2.324 2.467 . 0 0 "[ . 1 . 2]" 1
1311 1 60 ILE HA 1 63 ALA H . . 4.210 3.504 3.323 3.709 . 0 0 "[ . 1 . 2]" 1
1312 1 60 ILE HA 1 63 ALA MB . . 3.560 2.926 2.731 3.248 . 0 0 "[ . 1 . 2]" 1
1313 1 60 ILE HA 1 64 ALA H . . 4.880 4.571 4.273 4.786 . 0 0 "[ . 1 . 2]" 1
1314 1 60 ILE HB 1 60 ILE MD . . 3.290 2.346 2.240 2.414 . 0 0 "[ . 1 . 2]" 1
1315 1 60 ILE HB 1 61 THR H . . 3.470 2.621 2.373 2.815 . 0 0 "[ . 1 . 2]" 1
1316 1 60 ILE HB 1 61 THR HA . . 4.720 4.238 4.154 4.296 . 0 0 "[ . 1 . 2]" 1
1317 1 60 ILE MD 1 61 THR H . . 4.650 4.484 4.281 4.636 . 0 0 "[ . 1 . 2]" 1
1318 1 60 ILE HG12 1 60 ILE MG . . 3.140 2.229 2.075 2.307 . 0 0 "[ . 1 . 2]" 1
1319 1 60 ILE HG12 1 61 THR H . . 5.340 5.038 4.929 5.130 . 0 0 "[ . 1 . 2]" 1
1320 1 60 ILE HG13 1 60 ILE MG . . 3.450 3.183 3.147 3.198 . 0 0 "[ . 1 . 2]" 1
1321 1 60 ILE HG13 1 61 THR H . . 4.550 4.250 4.137 4.323 . 0 0 "[ . 1 . 2]" 1
1322 1 60 ILE MG 1 61 THR H . . 3.920 3.443 3.214 3.595 . 0 0 "[ . 1 . 2]" 1
1323 1 60 ILE MG 1 61 THR HA . . 4.000 3.476 3.253 3.635 . 0 0 "[ . 1 . 2]" 1
1324 1 60 ILE MG 1 64 ALA H . . 4.680 4.009 3.779 4.308 . 0 0 "[ . 1 . 2]" 1
1325 1 60 ILE MG 1 64 ALA MB . . 3.780 3.646 2.984 3.774 . 0 0 "[ . 1 . 2]" 1
1326 1 61 THR H 1 61 THR HB . . 3.250 2.676 2.575 2.854 . 0 0 "[ . 1 . 2]" 1
1327 1 61 THR H 1 61 THR MG . . 3.910 3.754 3.704 3.770 . 0 0 "[ . 1 . 2]" 1
1328 1 61 THR H 1 62 LYS H . . 3.480 2.720 2.619 2.828 . 0 0 "[ . 1 . 2]" 1
1329 1 61 THR H 1 63 ALA H . . 5.010 4.364 4.169 4.804 . 0 0 "[ . 1 . 2]" 1
1330 1 61 THR H 1 63 ALA MB . . 5.500 5.026 4.858 5.301 . 0 0 "[ . 1 . 2]" 1
1331 1 61 THR H 1 64 ALA H . . 5.500 4.940 4.732 5.101 . 0 0 "[ . 1 . 2]" 1
1332 1 61 THR HA 1 61 THR MG . . 3.060 2.293 2.147 2.433 . 0 0 "[ . 1 . 2]" 1
1333 1 61 THR HA 1 64 ALA H . . 3.830 3.481 3.273 3.687 . 0 0 "[ . 1 . 2]" 1
1334 1 61 THR HA 1 64 ALA MB . . 3.130 2.616 2.412 2.757 . 0 0 "[ . 1 . 2]" 1
1335 1 61 THR HA 1 65 LYS H . . 5.010 4.827 3.881 5.001 . 0 0 "[ . 1 . 2]" 1
1336 1 61 THR HB 1 62 LYS H . . 3.470 2.680 2.514 2.887 . 0 0 "[ . 1 . 2]" 1
1337 1 61 THR HB 1 62 LYS QB . . 5.000 4.068 3.929 4.223 . 0 0 "[ . 1 . 2]" 1
1338 1 61 THR HB 1 64 ALA MB . . 5.010 4.893 4.683 5.010 . 6 0 "[ . 1 . 2]" 1
1339 1 61 THR MG 1 62 LYS H . . 3.970 3.685 3.422 3.966 . 0 0 "[ . 1 . 2]" 1
1340 1 61 THR MG 1 62 LYS HA . . 4.250 3.789 3.474 4.124 . 0 0 "[ . 1 . 2]" 1
1341 1 61 THR MG 1 64 ALA MB . . 3.930 3.210 3.019 3.461 . 0 0 "[ . 1 . 2]" 1
1342 1 62 LYS H 1 62 LYS HB2 . . 3.380 2.383 2.200 2.616 . 0 0 "[ . 1 . 2]" 1
1343 1 62 LYS H 1 62 LYS QB . . 2.930 2.206 2.137 2.251 . 0 0 "[ . 1 . 2]" 1
1344 1 62 LYS H 1 62 LYS HB3 . . 3.380 2.684 2.432 2.901 . 0 0 "[ . 1 . 2]" 1
1345 1 62 LYS H 1 62 LYS HG2 . . 4.910 4.480 4.180 4.634 . 0 0 "[ . 1 . 2]" 1
1346 1 62 LYS H 1 62 LYS QG . . 4.250 3.931 3.822 4.041 . 0 0 "[ . 1 . 2]" 1
1347 1 62 LYS H 1 62 LYS HG3 . . 4.910 4.365 4.147 4.495 . 0 0 "[ . 1 . 2]" 1
1348 1 62 LYS H 1 63 ALA H . . 3.360 2.730 2.580 2.880 . 0 0 "[ . 1 . 2]" 1
1349 1 62 LYS H 1 63 ALA MB . . 5.270 4.326 4.215 4.428 . 0 0 "[ . 1 . 2]" 1
1350 1 62 LYS HA 1 62 LYS HD2 . . 5.120 4.071 2.349 4.607 . 0 0 "[ . 1 . 2]" 1
1351 1 62 LYS HA 1 62 LYS QD . . 4.380 3.593 2.324 4.073 . 0 0 "[ . 1 . 2]" 1
1352 1 62 LYS HA 1 62 LYS HD3 . . 5.120 4.182 3.103 4.755 . 0 0 "[ . 1 . 2]" 1
1353 1 62 LYS HA 1 62 LYS HG2 . . 4.020 3.047 2.204 3.857 . 0 0 "[ . 1 . 2]" 1
1354 1 62 LYS HA 1 62 LYS QG . . 3.440 2.386 2.163 2.855 . 0 0 "[ . 1 . 2]" 1
1355 1 62 LYS HA 1 62 LYS HG3 . . 4.020 2.679 2.205 3.513 . 0 0 "[ . 1 . 2]" 1
1356 1 62 LYS HA 1 65 LYS H . . 3.840 3.632 3.257 3.814 . 0 0 "[ . 1 . 2]" 1
1357 1 62 LYS HA 1 65 LYS QB . . 3.880 3.513 3.092 3.886 0.006 19 0 "[ . 1 . 2]" 1
1358 1 62 LYS HA 1 65 LYS QD . . 4.870 4.051 2.153 4.870 . 0 0 "[ . 1 . 2]" 1
1359 1 62 LYS HA 1 65 LYS QG . . 4.670 3.160 2.027 4.299 . 0 0 "[ . 1 . 2]" 1
1360 1 62 LYS QB 1 62 LYS QD . . 3.210 2.133 2.062 2.243 . 0 0 "[ . 1 . 2]" 1
1361 1 62 LYS QB 1 63 ALA H . . 3.750 2.473 2.206 2.699 . 0 0 "[ . 1 . 2]" 1
1362 1 62 LYS QE 1 66 LEU MD1 . . 4.780 4.062 2.992 4.781 0.001 13 0 "[ . 1 . 2]" 1
1363 1 62 LYS QE 1 66 LEU QD . . 4.140 3.174 2.292 3.885 . 0 0 "[ . 1 . 2]" 1
1364 1 62 LYS QE 1 66 LEU MD2 . . 4.780 3.664 2.310 4.777 . 0 0 "[ . 1 . 2]" 1
1365 1 62 LYS QG 1 63 ALA H . . 4.930 3.817 3.054 4.487 . 0 0 "[ . 1 . 2]" 1
1366 1 62 LYS QG 1 66 LEU QD . . 3.900 2.992 2.438 3.887 . 0 0 "[ . 1 . 2]" 1
1367 1 63 ALA H 1 63 ALA MB . . 2.860 2.131 2.025 2.240 . 0 0 "[ . 1 . 2]" 1
1368 1 63 ALA HA 1 65 LYS H . . 4.650 4.190 3.873 4.602 . 0 0 "[ . 1 . 2]" 1
1369 1 63 ALA HA 1 66 LEU H . . 3.820 3.321 3.161 3.623 . 0 0 "[ . 1 . 2]" 1
1370 1 63 ALA HA 1 66 LEU HB2 . . 3.370 2.692 2.519 3.025 . 0 0 "[ . 1 . 2]" 1
1371 1 63 ALA HA 1 66 LEU HB3 . . 4.410 4.283 4.129 4.411 0.001 8 0 "[ . 1 . 2]" 1
1372 1 63 ALA HA 1 66 LEU QD . . 3.400 2.645 2.092 3.401 0.001 13 0 "[ . 1 . 2]" 1
1373 1 63 ALA HA 1 66 LEU HG . . 4.010 3.516 2.613 3.962 . 0 0 "[ . 1 . 2]" 1
1374 1 63 ALA HA 1 67 LYS H . . 4.630 4.521 4.314 4.630 0.000 1 0 "[ . 1 . 2]" 1
1375 1 63 ALA MB 1 64 ALA HA . . 4.200 3.774 3.679 3.951 . 0 0 "[ . 1 . 2]" 1
1376 1 63 ALA MB 1 66 LEU QD . . 4.820 3.718 2.887 4.449 . 0 0 "[ . 1 . 2]" 1
1377 1 64 ALA H 1 64 ALA MB . . 2.810 2.122 2.027 2.229 . 0 0 "[ . 1 . 2]" 1
1378 1 64 ALA H 1 65 LYS H . . 3.290 2.743 2.445 3.010 . 0 0 "[ . 1 . 2]" 1
1379 1 64 ALA HA 1 67 LYS H . . 3.980 3.534 3.303 3.826 . 0 0 "[ . 1 . 2]" 1
1380 1 64 ALA HA 1 67 LYS HB2 . . 3.800 3.649 3.331 3.801 0.001 1 0 "[ . 1 . 2]" 1
1381 1 64 ALA HA 1 67 LYS HB3 . . 3.430 3.084 2.728 3.430 0.000 6 0 "[ . 1 . 2]" 1
1382 1 64 ALA HA 1 67 LYS HD2 . . 5.500 4.482 3.583 5.487 . 0 0 "[ . 1 . 2]" 1
1383 1 64 ALA HA 1 67 LYS HD3 . . 5.500 4.487 3.631 5.450 . 0 0 "[ . 1 . 2]" 1
1384 1 64 ALA HA 1 67 LYS QG . . 5.240 4.846 4.428 5.076 . 0 0 "[ . 1 . 2]" 1
1385 1 64 ALA MB 1 65 LYS H . . 3.280 2.666 2.265 2.920 . 0 0 "[ . 1 . 2]" 1
1386 1 64 ALA MB 1 65 LYS HA . . 4.220 3.785 3.644 3.865 . 0 0 "[ . 1 . 2]" 1
1387 1 65 LYS H 1 65 LYS HB2 . . 3.730 2.544 2.308 3.593 . 0 0 "[ . 1 . 2]" 1
1388 1 65 LYS H 1 65 LYS QB . . 3.100 2.451 2.280 2.578 . 0 0 "[ . 1 . 2]" 1
1389 1 65 LYS H 1 65 LYS HB3 . . 3.730 3.543 2.642 3.612 . 0 0 "[ . 1 . 2]" 1
1390 1 65 LYS H 1 65 LYS QD . . 4.510 3.476 1.782 4.477 . 0 0 "[ . 1 . 2]" 1
1391 1 65 LYS H 1 65 LYS HG2 . . 3.810 2.831 1.904 3.807 . 0 0 "[ . 1 . 2]" 1
1392 1 65 LYS H 1 65 LYS HG3 . . 3.810 3.064 1.956 3.513 . 0 0 "[ . 1 . 2]" 1
1393 1 65 LYS H 1 66 LEU H . . 3.210 2.604 2.459 2.910 . 0 0 "[ . 1 . 2]" 1
1394 1 65 LYS HA 1 65 LYS QD . . 3.730 2.978 2.056 3.754 0.024 19 0 "[ . 1 . 2]" 1
1395 1 65 LYS HA 1 65 LYS HG2 . . 4.090 2.967 2.258 4.202 0.112 19 0 "[ . 1 . 2]" 1
1396 1 65 LYS HA 1 65 LYS QG . . 3.420 2.620 2.220 3.410 . 0 0 "[ . 1 . 2]" 1
1397 1 65 LYS HA 1 65 LYS HG3 . . 4.090 3.384 2.374 3.849 . 0 0 "[ . 1 . 2]" 1
1398 1 65 LYS HA 1 68 GLU H . . 3.830 3.534 3.235 3.723 . 0 0 "[ . 1 . 2]" 1
1399 1 65 LYS HA 1 68 GLU QB . . 3.800 3.330 2.699 3.782 . 0 0 "[ . 1 . 2]" 1
1400 1 65 LYS HA 1 68 GLU HG2 . . 4.570 3.191 2.103 4.524 . 0 0 "[ . 1 . 2]" 1
1401 1 65 LYS HA 1 68 GLU HG3 . . 4.570 3.369 2.117 4.483 . 0 0 "[ . 1 . 2]" 1
1402 1 65 LYS HA 1 69 LYS H . . 5.000 4.734 4.152 5.001 0.001 17 0 "[ . 1 . 2]" 1
1403 1 65 LYS QB 1 65 LYS QD . . 3.450 2.227 2.087 2.639 . 0 0 "[ . 1 . 2]" 1
1404 1 65 LYS QB 1 68 GLU QB . . 5.340 4.547 3.993 5.304 . 0 0 "[ . 1 . 2]" 1
1405 1 65 LYS HB2 1 66 LEU H . . 4.040 2.785 2.365 3.819 . 0 0 "[ . 1 . 2]" 1
1406 1 65 LYS HB3 1 66 LEU H . . 4.040 3.745 3.277 4.046 0.006 19 0 "[ . 1 . 2]" 1
1407 1 66 LEU H 1 66 LEU HB2 . . 3.590 2.276 2.173 2.511 . 0 0 "[ . 1 . 2]" 1
1408 1 66 LEU H 1 66 LEU HB3 . . 3.920 3.533 3.486 3.608 . 0 0 "[ . 1 . 2]" 1
1409 1 66 LEU H 1 66 LEU MD1 . . 4.140 3.760 3.410 4.143 0.003 1 0 "[ . 1 . 2]" 1
1410 1 66 LEU H 1 66 LEU QD . . 3.550 2.667 1.921 3.422 . 0 0 "[ . 1 . 2]" 1
1411 1 66 LEU H 1 66 LEU MD2 . . 4.140 2.923 1.926 4.132 . 0 0 "[ . 1 . 2]" 1
1412 1 66 LEU H 1 66 LEU HG . . 4.130 3.251 2.229 4.051 . 0 0 "[ . 1 . 2]" 1
1413 1 66 LEU H 1 67 LYS H . . 3.480 2.604 2.361 2.854 . 0 0 "[ . 1 . 2]" 1
1414 1 66 LEU HA 1 66 LEU MD1 . . 4.110 3.036 2.005 3.907 . 0 0 "[ . 1 . 2]" 1
1415 1 66 LEU HA 1 66 LEU QD . . 2.760 2.056 1.916 2.275 . 0 0 "[ . 1 . 2]" 1
1416 1 66 LEU HA 1 66 LEU MD2 . . 4.110 2.239 1.980 2.700 . 0 0 "[ . 1 . 2]" 1
1417 1 66 LEU HA 1 66 LEU HG . . 3.700 3.270 2.633 3.718 0.018 13 0 "[ . 1 . 2]" 1
1418 1 66 LEU HA 1 69 LYS H . . 3.840 3.672 3.451 3.801 . 0 0 "[ . 1 . 2]" 1
1419 1 66 LEU HA 1 69 LYS QB . . 3.460 3.152 2.819 3.388 . 0 0 "[ . 1 . 2]" 1
1420 1 66 LEU HA 1 70 TYR H . . 4.540 4.366 3.989 4.533 . 0 0 "[ . 1 . 2]" 1
1421 1 66 LEU HB2 1 66 LEU QD . . 3.050 2.257 2.107 2.469 . 0 0 "[ . 1 . 2]" 1
1422 1 66 LEU HB2 1 67 LYS H . . 4.060 2.868 2.599 3.153 . 0 0 "[ . 1 . 2]" 1
1423 1 66 LEU HB3 1 66 LEU MD1 . . 3.410 2.347 2.052 2.535 . 0 0 "[ . 1 . 2]" 1
1424 1 66 LEU HB3 1 66 LEU QD . . 2.930 2.144 2.027 2.285 . 0 0 "[ . 1 . 2]" 1
1425 1 66 LEU HB3 1 66 LEU MD2 . . 3.410 2.730 2.160 3.196 . 0 0 "[ . 1 . 2]" 1
1426 1 66 LEU HB3 1 67 LYS H . . 3.850 3.546 3.160 3.814 . 0 0 "[ . 1 . 2]" 1
1427 1 66 LEU HB3 1 70 TYR H . . 5.500 4.996 4.712 5.424 . 0 0 "[ . 1 . 2]" 1
1428 1 66 LEU HB3 1 70 TYR QB . . 5.340 4.376 4.131 4.578 . 0 0 "[ . 1 . 2]" 1
1429 1 66 LEU QD 1 69 LYS H . . 5.120 4.763 4.454 5.080 . 0 0 "[ . 1 . 2]" 1
1430 1 66 LEU QD 1 69 LYS QB . . 4.280 3.640 3.188 3.996 . 0 0 "[ . 1 . 2]" 1
1431 1 66 LEU QD 1 69 LYS QD . . 4.510 3.865 3.386 4.505 . 0 0 "[ . 1 . 2]" 1
1432 1 66 LEU QD 1 69 LYS QE . . 4.800 4.072 2.508 4.794 . 0 0 "[ . 1 . 2]" 1
1433 1 67 LYS H 1 67 LYS HB2 . . 3.290 2.646 2.441 2.886 . 0 0 "[ . 1 . 2]" 1
1434 1 67 LYS H 1 67 LYS HB3 . . 3.320 2.425 2.254 2.623 . 0 0 "[ . 1 . 2]" 1
1435 1 67 LYS H 1 67 LYS QG . . 4.490 3.968 3.888 4.046 . 0 0 "[ . 1 . 2]" 1
1436 1 67 LYS H 1 68 GLU H . . 3.310 2.672 2.402 2.864 . 0 0 "[ . 1 . 2]" 1
1437 1 67 LYS HA 1 67 LYS HD2 . . 5.500 4.368 2.488 4.958 . 0 0 "[ . 1 . 2]" 1
1438 1 67 LYS HA 1 67 LYS QD . . 4.740 3.936 2.462 4.279 . 0 0 "[ . 1 . 2]" 1
1439 1 67 LYS HA 1 67 LYS HD3 . . 5.500 4.580 3.769 5.052 . 0 0 "[ . 1 . 2]" 1
1440 1 67 LYS HA 1 67 LYS QG . . 3.380 2.544 2.385 2.634 . 0 0 "[ . 1 . 2]" 1
1441 1 67 LYS HA 1 70 TYR H . . 3.920 3.316 3.081 3.595 . 0 0 "[ . 1 . 2]" 1
1442 1 67 LYS HA 1 70 TYR HB2 . . 3.770 3.222 2.747 3.723 . 0 0 "[ . 1 . 2]" 1
1443 1 67 LYS HA 1 70 TYR QB . . 3.170 2.428 2.267 2.582 . 0 0 "[ . 1 . 2]" 1
1444 1 67 LYS HA 1 70 TYR HB3 . . 3.770 2.527 2.380 2.658 . 0 0 "[ . 1 . 2]" 1
1445 1 67 LYS HA 1 70 TYR QD . . 4.310 3.872 3.063 4.059 . 0 0 "[ . 1 . 2]" 1
1446 1 67 LYS HA 1 71 GLU H . . 4.670 3.915 3.494 4.216 . 0 0 "[ . 1 . 2]" 1
1447 1 67 LYS HB2 1 68 GLU H . . 4.240 3.896 3.739 4.101 . 0 0 "[ . 1 . 2]" 1
1448 1 67 LYS HB2 1 70 TYR QD . . 5.500 5.386 4.661 5.501 0.001 16 0 "[ . 1 . 2]" 1
1449 1 67 LYS HB3 1 67 LYS HD2 . . 3.920 2.924 2.102 3.666 . 0 0 "[ . 1 . 2]" 1
1450 1 67 LYS HB3 1 67 LYS HD3 . . 3.920 2.738 2.202 3.682 . 0 0 "[ . 1 . 2]" 1
1451 1 67 LYS HB3 1 68 GLU H . . 3.930 2.565 2.330 2.881 . 0 0 "[ . 1 . 2]" 1
1452 1 67 LYS HB3 1 68 GLU HA . . 4.950 4.310 4.071 4.543 . 0 0 "[ . 1 . 2]" 1
1453 1 67 LYS QE 1 67 LYS QG . . 3.470 2.201 2.044 2.375 . 0 0 "[ . 1 . 2]" 1
1454 1 67 LYS QE 1 71 GLU HG2 . . 5.100 4.082 2.925 4.977 . 0 0 "[ . 1 . 2]" 1
1455 1 67 LYS QE 1 71 GLU HG3 . . 5.100 3.530 2.249 4.719 . 0 0 "[ . 1 . 2]" 1
1456 1 67 LYS QG 1 68 GLU H . . 4.230 3.472 2.895 4.038 . 0 0 "[ . 1 . 2]" 1
1457 1 67 LYS QG 1 70 TYR H . . 5.500 4.662 4.385 5.135 . 0 0 "[ . 1 . 2]" 1
1458 1 67 LYS QG 1 70 TYR HB2 . . 5.500 4.857 4.385 5.335 . 0 0 "[ . 1 . 2]" 1
1459 1 67 LYS QG 1 70 TYR QB . . 4.760 3.480 3.159 3.778 . 0 0 "[ . 1 . 2]" 1
1460 1 67 LYS QG 1 70 TYR HB3 . . 5.500 3.567 3.239 3.880 . 0 0 "[ . 1 . 2]" 1
1461 1 67 LYS QG 1 70 TYR QD . . 4.580 3.648 3.087 4.176 . 0 0 "[ . 1 . 2]" 1
1462 1 67 LYS QG 1 71 GLU H . . 4.860 3.737 3.391 4.158 . 0 0 "[ . 1 . 2]" 1
1463 1 67 LYS QG 1 71 GLU HG2 . . 4.180 3.571 2.642 4.095 . 0 0 "[ . 1 . 2]" 1
1464 1 67 LYS QG 1 71 GLU QG . . 3.630 2.511 2.157 2.994 . 0 0 "[ . 1 . 2]" 1
1465 1 67 LYS QG 1 71 GLU HG3 . . 4.180 2.586 2.179 3.225 . 0 0 "[ . 1 . 2]" 1
1466 1 68 GLU H 1 68 GLU QB . . 3.120 2.390 2.203 2.552 . 0 0 "[ . 1 . 2]" 1
1467 1 68 GLU H 1 68 GLU HG2 . . 4.070 2.583 2.054 3.357 . 0 0 "[ . 1 . 2]" 1
1468 1 68 GLU H 1 68 GLU QG . . 3.490 2.355 2.042 2.718 . 0 0 "[ . 1 . 2]" 1
1469 1 68 GLU H 1 68 GLU HG3 . . 4.070 3.329 2.083 4.032 . 0 0 "[ . 1 . 2]" 1
1470 1 68 GLU H 1 69 LYS H . . 3.460 2.833 2.526 3.035 . 0 0 "[ . 1 . 2]" 1
1471 1 68 GLU HA 1 68 GLU HG2 . . 3.960 3.079 2.394 3.863 . 0 0 "[ . 1 . 2]" 1
1472 1 68 GLU HA 1 68 GLU HG3 . . 3.960 3.591 3.019 3.781 . 0 0 "[ . 1 . 2]" 1
1473 1 68 GLU HA 1 71 GLU H . . 4.210 3.963 3.702 4.171 . 0 0 "[ . 1 . 2]" 1
1474 1 68 GLU HA 1 71 GLU QB . . 3.940 3.316 2.922 3.837 . 0 0 "[ . 1 . 2]" 1
1475 1 68 GLU HA 1 71 GLU QG . . 4.460 3.635 3.129 4.069 . 0 0 "[ . 1 . 2]" 1
1476 1 68 GLU QB 1 69 LYS H . . 3.580 2.812 2.224 3.573 . 0 0 "[ . 1 . 2]" 1
1477 1 68 GLU QB 1 69 LYS QB . . 5.500 4.301 3.730 5.011 . 0 0 "[ . 1 . 2]" 1
1478 1 68 GLU QG 1 69 LYS H . . 4.420 3.427 2.003 4.365 . 0 0 "[ . 1 . 2]" 1
1479 1 68 GLU HG2 1 69 LYS H . . 5.190 3.924 2.267 4.944 . 0 0 "[ . 1 . 2]" 1
1480 1 68 GLU HG3 1 69 LYS H . . 5.190 3.912 2.063 5.093 . 0 0 "[ . 1 . 2]" 1
1481 1 69 LYS H 1 69 LYS QB . . 2.980 2.268 2.155 2.479 . 0 0 "[ . 1 . 2]" 1
1482 1 69 LYS H 1 69 LYS QD . . 5.140 4.069 2.292 4.429 . 0 0 "[ . 1 . 2]" 1
1483 1 69 LYS H 1 69 LYS QG . . 4.340 3.194 2.122 4.077 . 0 0 "[ . 1 . 2]" 1
1484 1 69 LYS H 1 70 TYR H . . 3.310 2.578 2.270 2.817 . 0 0 "[ . 1 . 2]" 1
1485 1 69 LYS HA 1 69 LYS HD2 . . 4.600 4.175 3.312 4.585 . 0 0 "[ . 1 . 2]" 1
1486 1 69 LYS HA 1 69 LYS QD . . 3.890 3.669 2.371 3.928 0.038 20 0 "[ . 1 . 2]" 1
1487 1 69 LYS HA 1 69 LYS HD3 . . 4.600 4.178 2.397 4.534 . 0 0 "[ . 1 . 2]" 1
1488 1 69 LYS HA 1 69 LYS QG . . 3.620 2.279 2.176 2.725 . 0 0 "[ . 1 . 2]" 1
1489 1 69 LYS QB 1 70 TYR H . . 3.450 2.620 2.369 3.063 . 0 0 "[ . 1 . 2]" 1
1490 1 69 LYS QB 1 70 TYR HA . . 4.860 3.884 3.756 4.192 . 0 0 "[ . 1 . 2]" 1
1491 1 69 LYS QB 1 70 TYR QD . . 5.500 5.388 5.252 5.500 . 0 0 "[ . 1 . 2]" 1
1492 1 69 LYS QD 1 70 TYR H . . 5.340 4.748 3.240 5.283 . 0 0 "[ . 1 . 2]" 1
1493 1 69 LYS QG 1 70 TYR H . . 5.040 4.192 3.931 4.461 . 0 0 "[ . 1 . 2]" 1
1494 1 70 TYR H 1 70 TYR HB2 . . 3.290 2.564 2.438 2.760 . 0 0 "[ . 1 . 2]" 1
1495 1 70 TYR H 1 70 TYR HB3 . . 3.290 2.510 2.318 2.659 . 0 0 "[ . 1 . 2]" 1
1496 1 70 TYR H 1 70 TYR QD . . 4.320 4.185 4.148 4.217 . 0 0 "[ . 1 . 2]" 1
1497 1 70 TYR H 1 71 GLU H . . 3.480 2.856 2.598 3.078 . 0 0 "[ . 1 . 2]" 1
1498 1 70 TYR HA 1 70 TYR QD . . 3.390 2.542 2.325 2.886 . 0 0 "[ . 1 . 2]" 1
1499 1 70 TYR HA 1 72 LYS H . . 4.750 4.264 3.863 4.621 . 0 0 "[ . 1 . 2]" 1
1500 1 70 TYR HA 1 73 ASP H . . 4.290 3.546 3.291 3.767 . 0 0 "[ . 1 . 2]" 1
1501 1 70 TYR HA 1 73 ASP HB2 . . 3.440 3.058 2.652 3.439 . 0 0 "[ . 1 . 2]" 1
1502 1 70 TYR HA 1 73 ASP HB3 . . 4.660 4.127 3.189 4.651 . 0 0 "[ . 1 . 2]" 1
1503 1 70 TYR HA 1 74 VAL H . . 4.110 3.981 3.797 4.109 . 0 0 "[ . 1 . 2]" 1
1504 1 70 TYR HA 1 74 VAL QG . . 4.740 3.587 3.175 3.816 . 0 0 "[ . 1 . 2]" 1
1505 1 70 TYR QB 1 71 GLU H . . 3.350 2.328 2.045 2.655 . 0 0 "[ . 1 . 2]" 1
1506 1 70 TYR HB2 1 71 GLU H . . 4.040 3.758 3.578 3.966 . 0 0 "[ . 1 . 2]" 1
1507 1 70 TYR HB3 1 71 GLU H . . 4.040 2.352 2.057 2.697 . 0 0 "[ . 1 . 2]" 1
1508 1 70 TYR QD 1 71 GLU H . . 3.960 3.280 2.732 3.849 . 0 0 "[ . 1 . 2]" 1
1509 1 70 TYR QD 1 71 GLU HA . . 4.030 3.576 3.131 3.971 . 0 0 "[ . 1 . 2]" 1
1510 1 70 TYR QD 1 71 GLU HG2 . . 3.990 3.509 2.247 3.985 . 0 0 "[ . 1 . 2]" 1
1511 1 70 TYR QD 1 71 GLU HG3 . . 3.990 3.691 3.122 3.988 . 0 0 "[ . 1 . 2]" 1
1512 1 70 TYR QD 1 74 VAL H . . 5.000 4.566 4.338 4.813 . 0 0 "[ . 1 . 2]" 1
1513 1 70 TYR QD 1 74 VAL MG1 . . 4.550 4.178 3.280 4.551 0.001 10 0 "[ . 1 . 2]" 1
1514 1 70 TYR QD 1 74 VAL QG . . 3.740 2.797 2.623 3.070 . 0 0 "[ . 1 . 2]" 1
1515 1 70 TYR QD 1 74 VAL MG2 . . 4.550 2.929 2.640 3.578 . 0 0 "[ . 1 . 2]" 1
1516 1 70 TYR QE 1 74 VAL MG1 . . 4.240 3.313 2.451 3.763 . 0 0 "[ . 1 . 2]" 1
1517 1 70 TYR QE 1 74 VAL QG . . 3.380 2.434 2.197 2.740 . 0 0 "[ . 1 . 2]" 1
1518 1 70 TYR QE 1 74 VAL MG2 . . 4.240 2.714 2.216 3.586 . 0 0 "[ . 1 . 2]" 1
1519 1 71 GLU H 1 71 GLU HB2 . . 3.710 2.498 2.310 2.677 . 0 0 "[ . 1 . 2]" 1
1520 1 71 GLU H 1 71 GLU QB . . 3.090 2.452 2.282 2.608 . 0 0 "[ . 1 . 2]" 1
1521 1 71 GLU H 1 71 GLU HB3 . . 3.710 3.590 3.554 3.619 . 0 0 "[ . 1 . 2]" 1
1522 1 71 GLU H 1 71 GLU HG2 . . 3.810 3.160 2.410 3.593 . 0 0 "[ . 1 . 2]" 1
1523 1 71 GLU H 1 71 GLU QG . . 3.290 2.226 1.940 2.543 . 0 0 "[ . 1 . 2]" 1
1524 1 71 GLU H 1 71 GLU HG3 . . 3.810 2.412 1.959 3.459 . 0 0 "[ . 1 . 2]" 1
1525 1 71 GLU H 1 72 LYS H . . 3.400 2.837 2.659 2.995 . 0 0 "[ . 1 . 2]" 1
1526 1 71 GLU HA 1 71 GLU HG2 . . 3.860 2.480 2.322 2.641 . 0 0 "[ . 1 . 2]" 1
1527 1 71 GLU HA 1 71 GLU QG . . 3.210 2.395 2.254 2.588 . 0 0 "[ . 1 . 2]" 1
1528 1 71 GLU HA 1 71 GLU HG3 . . 3.860 3.197 2.934 3.714 . 0 0 "[ . 1 . 2]" 1
1529 1 71 GLU HA 1 74 VAL H . . 4.150 3.659 3.213 3.929 . 0 0 "[ . 1 . 2]" 1
1530 1 71 GLU HA 1 74 VAL HB . . 4.550 3.120 2.140 4.536 . 0 0 "[ . 1 . 2]" 1
1531 1 71 GLU HA 1 74 VAL MG1 . . 4.050 3.816 3.522 4.039 . 0 0 "[ . 1 . 2]" 1
1532 1 71 GLU HA 1 74 VAL MG2 . . 4.050 2.608 1.863 3.402 . 0 0 "[ . 1 . 2]" 1
1533 1 71 GLU QB 1 72 LYS H . . 3.570 2.604 2.380 2.981 . 0 0 "[ . 1 . 2]" 1
1534 1 71 GLU QB 1 72 LYS HA . . 5.030 3.874 3.813 3.993 . 0 0 "[ . 1 . 2]" 1
1535 1 71 GLU HB2 1 72 LYS H . . 4.410 2.675 2.418 3.101 . 0 0 "[ . 1 . 2]" 1
1536 1 71 GLU HB3 1 72 LYS H . . 4.410 3.602 3.379 3.865 . 0 0 "[ . 1 . 2]" 1
1537 1 72 LYS H 1 72 LYS HB2 . . 3.720 2.368 2.185 2.794 . 0 0 "[ . 1 . 2]" 1
1538 1 72 LYS H 1 72 LYS QB . . 3.040 2.241 2.148 2.438 . 0 0 "[ . 1 . 2]" 1
1539 1 72 LYS H 1 72 LYS HB3 . . 3.720 3.106 2.359 3.588 . 0 0 "[ . 1 . 2]" 1
1540 1 72 LYS H 1 72 LYS QD . . 5.180 4.132 2.014 4.573 . 0 0 "[ . 1 . 2]" 1
1541 1 72 LYS H 1 72 LYS HG2 . . 4.650 3.853 2.207 4.634 . 0 0 "[ . 1 . 2]" 1
1542 1 72 LYS H 1 72 LYS QG . . 3.940 3.267 2.182 3.941 0.001 19 0 "[ . 1 . 2]" 1
1543 1 72 LYS H 1 72 LYS HG3 . . 4.650 3.736 2.212 4.515 . 0 0 "[ . 1 . 2]" 1
1544 1 72 LYS H 1 73 ASP H . . 3.500 2.772 2.417 3.034 . 0 0 "[ . 1 . 2]" 1
1545 1 72 LYS H 1 73 ASP HB2 . . 5.120 4.719 4.455 4.971 . 0 0 "[ . 1 . 2]" 1
1546 1 72 LYS HA 1 72 LYS QD . . 4.280 3.253 2.186 4.130 . 0 0 "[ . 1 . 2]" 1
1547 1 72 LYS HA 1 72 LYS HG2 . . 3.880 2.783 2.252 3.880 0.000 7 0 "[ . 1 . 2]" 1
1548 1 72 LYS HA 1 72 LYS QG . . 3.280 2.393 2.150 2.914 . 0 0 "[ . 1 . 2]" 1
1549 1 72 LYS HA 1 72 LYS HG3 . . 3.880 3.065 2.189 3.764 . 0 0 "[ . 1 . 2]" 1
1550 1 72 LYS HA 1 74 VAL H . . 5.500 4.647 3.934 5.417 . 0 0 "[ . 1 . 2]" 1
1551 1 72 LYS HA 1 75 ALA MB . . 3.760 2.918 2.599 3.318 . 0 0 "[ . 1 . 2]" 1
1552 1 72 LYS HA 1 76 ASP H . . 4.380 4.149 3.771 4.353 . 0 0 "[ . 1 . 2]" 1
1553 1 72 LYS QB 1 73 ASP H . . 3.520 2.456 1.891 3.134 . 0 0 "[ . 1 . 2]" 1
1554 1 72 LYS QB 1 73 ASP HA . . 5.030 3.943 3.745 4.276 . 0 0 "[ . 1 . 2]" 1
1555 1 72 LYS HB2 1 73 ASP H . . 4.020 3.160 2.251 4.002 . 0 0 "[ . 1 . 2]" 1
1556 1 72 LYS HB3 1 73 ASP H . . 4.020 2.870 1.903 3.954 . 0 0 "[ . 1 . 2]" 1
1557 1 72 LYS QG 1 73 ASP H . . 5.190 3.986 2.768 4.694 . 0 0 "[ . 1 . 2]" 1
1558 1 73 ASP H 1 73 ASP HB2 . . 3.470 2.267 2.175 2.487 . 0 0 "[ . 1 . 2]" 1
1559 1 73 ASP H 1 73 ASP HB3 . . 3.920 3.335 2.808 3.593 . 0 0 "[ . 1 . 2]" 1
1560 1 73 ASP H 1 75 ALA MB . . 5.500 4.811 4.309 5.238 . 0 0 "[ . 1 . 2]" 1
1561 1 73 ASP HA 1 75 ALA H . . 4.870 4.423 4.055 4.834 . 0 0 "[ . 1 . 2]" 1
1562 1 73 ASP HA 1 76 ASP H . . 4.460 3.653 3.381 3.979 . 0 0 "[ . 1 . 2]" 1
1563 1 73 ASP HA 1 76 ASP QB . . 3.340 2.839 2.491 3.207 . 0 0 "[ . 1 . 2]" 1
1564 1 73 ASP HB2 1 74 VAL H . . 3.790 2.965 2.281 3.746 . 0 0 "[ . 1 . 2]" 1
1565 1 73 ASP HB2 1 74 VAL QG . . 4.940 3.803 3.343 4.712 . 0 0 "[ . 1 . 2]" 1
1566 1 73 ASP HB3 1 74 VAL H . . 4.220 3.061 2.012 3.665 . 0 0 "[ . 1 . 2]" 1
1567 1 74 VAL H 1 74 VAL HB . . 3.620 2.809 2.333 3.617 . 0 0 "[ . 1 . 2]" 1
1568 1 74 VAL H 1 74 VAL MG1 . . 3.950 3.394 2.395 3.769 . 0 0 "[ . 1 . 2]" 1
1569 1 74 VAL H 1 74 VAL QG . . 3.060 2.157 1.846 2.591 . 0 0 "[ . 1 . 2]" 1
1570 1 74 VAL H 1 74 VAL MG2 . . 3.950 2.191 1.877 2.645 . 0 0 "[ . 1 . 2]" 1
1571 1 74 VAL H 1 75 ALA H . . 3.400 2.745 2.557 2.900 . 0 0 "[ . 1 . 2]" 1
1572 1 74 VAL H 1 75 ALA HA . . 5.500 5.338 5.178 5.463 . 0 0 "[ . 1 . 2]" 1
1573 1 74 VAL H 1 75 ALA MB . . 4.550 4.337 4.178 4.539 . 0 0 "[ . 1 . 2]" 1
1574 1 74 VAL HA 1 74 VAL MG1 . . 3.380 2.328 2.054 2.530 . 0 0 "[ . 1 . 2]" 1
1575 1 74 VAL HA 1 74 VAL QG . . 2.890 2.084 2.023 2.170 . 0 0 "[ . 1 . 2]" 1
1576 1 74 VAL HA 1 74 VAL MG2 . . 3.380 2.560 2.128 3.181 . 0 0 "[ . 1 . 2]" 1
1577 1 74 VAL HA 1 77 TYR H . . 4.130 3.715 3.469 4.095 . 0 0 "[ . 1 . 2]" 1
1578 1 74 VAL HA 1 77 TYR QB . . 3.380 2.635 2.213 3.017 . 0 0 "[ . 1 . 2]" 1
1579 1 74 VAL HA 1 77 TYR QD . . 4.480 4.157 3.028 4.431 . 0 0 "[ . 1 . 2]" 1
1580 1 74 VAL HB 1 75 ALA H . . 3.810 2.844 2.264 3.646 . 0 0 "[ . 1 . 2]" 1
1581 1 74 VAL HB 1 75 ALA MB . . 4.660 4.146 3.783 4.613 . 0 0 "[ . 1 . 2]" 1
1582 1 74 VAL QG 1 75 ALA H . . 3.820 2.754 1.888 3.229 . 0 0 "[ . 1 . 2]" 1
1583 1 74 VAL QG 1 75 ALA HA . . 4.050 3.398 3.007 3.841 . 0 0 "[ . 1 . 2]" 1
1584 1 74 VAL QG 1 77 TYR QD . . 5.370 4.144 3.305 4.830 . 0 0 "[ . 1 . 2]" 1
1585 1 74 VAL MG1 1 75 ALA H . . 4.390 3.511 2.999 4.163 . 0 0 "[ . 1 . 2]" 1
1586 1 74 VAL MG1 1 77 TYR QB . . 4.860 3.810 3.275 4.151 . 0 0 "[ . 1 . 2]" 1
1587 1 74 VAL MG2 1 75 ALA H . . 4.390 3.305 1.891 4.025 . 0 0 "[ . 1 . 2]" 1
1588 1 74 VAL MG2 1 77 TYR QB . . 4.860 4.410 4.100 4.801 . 0 0 "[ . 1 . 2]" 1
1589 1 75 ALA H 1 75 ALA MB . . 2.960 2.108 2.031 2.221 . 0 0 "[ . 1 . 2]" 1
1590 1 75 ALA H 1 76 ASP H . . 3.680 2.756 2.532 3.104 . 0 0 "[ . 1 . 2]" 1
1591 1 75 ALA HA 1 78 LYS H . . 5.020 3.720 3.441 4.019 . 0 0 "[ . 1 . 2]" 1
1592 1 75 ALA HA 1 78 LYS QB . . 3.900 3.387 2.769 3.899 . 0 0 "[ . 1 . 2]" 1
1593 1 75 ALA MB 1 76 ASP H . . 3.570 2.457 2.255 2.699 . 0 0 "[ . 1 . 2]" 1
1594 1 75 ALA MB 1 76 ASP HA . . 4.630 3.710 3.584 3.868 . 0 0 "[ . 1 . 2]" 1
1595 1 75 ALA MB 1 76 ASP QB . . 4.910 3.953 3.662 4.309 . 0 0 "[ . 1 . 2]" 1
1596 1 75 ALA MB 1 77 TYR H . . 5.190 4.354 4.006 4.697 . 0 0 "[ . 1 . 2]" 1
1597 1 76 ASP H 1 76 ASP QB . . 3.230 2.278 2.181 2.456 . 0 0 "[ . 1 . 2]" 1
1598 1 76 ASP QB 1 77 TYR H . . 3.630 2.733 2.374 3.275 . 0 0 "[ . 1 . 2]" 1
1599 1 76 ASP QB 1 77 TYR HA . . 4.950 4.020 3.786 4.541 . 0 0 "[ . 1 . 2]" 1
1600 1 77 TYR H 1 77 TYR QB . . 3.070 2.233 2.177 2.267 . 0 0 "[ . 1 . 2]" 1
1601 1 77 TYR H 1 77 TYR QD . . 4.360 4.127 3.826 4.207 . 0 0 "[ . 1 . 2]" 1
1602 1 77 TYR HA 1 77 TYR QD . . 3.420 3.050 2.087 3.340 . 0 0 "[ . 1 . 2]" 1
1603 1 77 TYR QB 1 78 LYS H . . 3.840 2.608 2.112 3.148 . 0 0 "[ . 1 . 2]" 1
1604 1 77 TYR QD 1 78 LYS H . . 4.520 3.032 2.181 4.293 . 0 0 "[ . 1 . 2]" 1
1605 1 77 TYR QD 1 78 LYS HA . . 4.450 3.083 2.484 4.421 . 0 0 "[ . 1 . 2]" 1
1606 1 77 TYR QD 1 78 LYS HG2 . . 4.980 3.456 2.120 4.972 . 0 0 "[ . 1 . 2]" 1
1607 1 77 TYR QD 1 78 LYS QG . . 4.340 2.838 1.939 3.979 . 0 0 "[ . 1 . 2]" 1
1608 1 77 TYR QD 1 78 LYS HG3 . . 4.980 3.302 2.020 4.941 . 0 0 "[ . 1 . 2]" 1
1609 1 77 TYR QD 1 80 LYS QD . . 5.060 4.690 3.358 5.057 . 0 0 "[ . 1 . 2]" 1
1610 1 78 LYS H 1 78 LYS QB . . 3.430 2.319 2.155 2.741 . 0 0 "[ . 1 . 2]" 1
1611 1 78 LYS H 1 78 LYS HG2 . . 4.660 3.704 2.336 4.571 . 0 0 "[ . 1 . 2]" 1
1612 1 78 LYS H 1 78 LYS QG . . 3.950 2.996 2.256 3.953 0.003 6 0 "[ . 1 . 2]" 1
1613 1 78 LYS H 1 78 LYS HG3 . . 4.660 3.350 2.392 4.551 . 0 0 "[ . 1 . 2]" 1
1614 1 78 LYS H 1 80 LYS QD . . 5.500 5.009 4.053 5.499 . 0 0 "[ . 1 . 2]" 1
1615 1 78 LYS HA 1 78 LYS QG . . 3.490 2.400 2.162 3.342 . 0 0 "[ . 1 . 2]" 1
1616 1 78 LYS HA 1 80 LYS QD . . 4.430 3.447 2.381 4.425 . 0 0 "[ . 1 . 2]" 1
1617 1 78 LYS QG 1 79 SER H . . 5.330 3.994 1.922 4.630 . 0 0 "[ . 1 . 2]" 1
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